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xray-atlas

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5
chemical_formula
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9 values
description
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9 values
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large_stringclasses
8 values
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energy
float64
270
2.53k
intensity
float64
-0.76
5.51
error
null
e_field_azimuth
int32
0
0
e_field_polar
float64
20
90
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
270.36053
0.061085
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
270.45474
0.05982
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
270.56006
0.0607
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
270.66031
0.057122
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
270.76205
0.058219
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
270.86011
0.061419
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
270.96066
0.059681
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.05988
0.056097
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.16003
0.059296
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.26044
0.056104
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.36066
0.061506
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.45993
0.050395
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.56018
0.049957
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.66003
0.056404
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.75974
0.059425
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.85861
0.049287
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
271.95999
0.051108
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.06009
0.051981
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.15991
0.049942
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.25977
0.046981
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.36005
0.051678
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.46051
0.053017
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.55988
0.048994
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.66025
0.043066
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.75983
0.04567
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.86038
0.049127
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
272.95963
0.042025
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.06024
0.04281
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.15982
0.044078
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.26047
0.047188
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.35983
0.03876
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.46121
0.040038
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.56113
0.038744
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.66043
0.044074
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.76059
0.03568
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.86053
0.039064
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
273.96066
0.038601
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.06076
0.040893
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.1597
0.035151
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.26031
0.037848
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.36014
0.038646
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.45975
0.040406
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.55722
0.032358
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.65979
0.034131
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.75931
0.035747
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.85947
0.033066
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
274.96011
0.033104
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.06033
0.032033
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.15997
0.034114
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.25568
0.028194
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.3606
0.031667
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.45895
0.030727
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.55966
0.035319
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.66046
0.026363
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.76053
0.029554
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.85681
0.025021
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
275.96326
0.030442
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.06015
0.022387
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.16025
0.026628
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.26056
0.027923
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.35974
0.027005
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.45956
0.021416
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.56018
0.023619
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.66019
0.024053
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.75934
0.02296
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.86057
0.01751
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
276.96094
0.019413
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.06076
0.020711
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.16086
0.01925
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.26001
0.015198
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.35809
0.01745
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.45276
0.024317
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.56015
0.016527
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.6601
0.014858
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.76062
0.015711
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.85938
0.018806
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
277.96158
0.015529
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.06018
0.011965
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.15991
0.014217
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.25995
0.016323
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.36011
0.009454
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.45975
0.010399
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.56
0.011148
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.66025
0.016237
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.7612
0.005952
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.85886
0.012625
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
278.95935
0.00905
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.0596
0.011019
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.16058
0.003297
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.26053
0.00134
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.35968
0.00549
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.46057
0.00649
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.56046
0.000722
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.65988
0.002164
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.7605
0.001618
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.86023
0.009375
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
279.95935
-0.001262
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
280.06015
0.001963
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
280.16022
0.001458
null
0
30
ITIC
[]
C94H82N4O2S4
3,9-bis(2-methylene-(3-(1,1-dicyanomethylene)-indanone))-5,5,11,11-tetrakis(4-hexylphenyl)-dithieno[2,3-d:2',3'-d']-s-indaceno[1,2-b:5,6-b']dithiophene
O=C(C1=C(C/2=C(C#N)\[N+]#[C-])C=CC=C1)C2=C/C3=CC(SC4=C5C(C6=CC=C(CCCCCC)C=C6)(C7=CC=C(CCCCCC)C=C7)C8=C4C=C(C(C9=CC=C(CCCCCC)C=C9)(C%10=CC=C(CCCCCC)C=C%10)C%11=C%12SC%13=C%11SC(/C=C%14C(C(C=CC=C%15)=C%15C\%14=C([N+]#[C-])/C#N)=O)=C%13)C%12=C8)=C5S3
InChI=1S/C94H82N4O2S4/c1-7-11-15-19-27-59-35-43-63(44-36-59)93(64-45-37-60(38-46-64)28-20-16-12-8-2)77-55-74-78(56-73(77)89-85(93)91-81(103-89)53-67(101-91)51-75-83(79(57-95)97-5)69-31-23-25-33-71(69)87(75)99)94(65-47-39-61(40-48-65)29-21-17-13-9-3,66-49-41-62(42-50-66)30-22-18-14-10-4)86-90(74)104-82-54-68(102-92(82)86)52-76-84(80(58-96)98-6)70-32-24-26-34-72(70)88(76)100/h23-26,31-56H,7-22,27-30H2,1-4H3/b75-51-,76-52-,83-79-,84-80+
https://raw.githubuserco…de7ebc7/ITIC.svg
Harlan Heilman
Washington State University
Collins
harlan.heilman@wsu.edu
null
ANSTO
SXR
C(K)
0 - 1
TEY
1-Material
spin-coating
1500 rpm for 60 seconds, concentration: 10 g/L
280.26093
0.002176
null
0
30
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