Information card for entry 2000443

Structure parameters

• Formula: C26 H8 N8 S6
• Calculated formula: C26 H8 N8 S6
• SMILES: c1ccc2c(c1)SC(=C1Sc3c(S1)cccc3)S2.N#CC(=c1c2nsnc2c(=C(C#N)C#N)c2c1nsn2)C#N
• Title of publication: Structure of the charge-transfer complex of (DBTTF)(BTDA-TCNQ)
• Authors of publication: Iwasaki, K.; Ida, T.; Kawamoto, A.; Ugawa, A.; Yamashita, Y.; Yakushi, K.; Suzuki, T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 11
• Pages of publication: 1982 - 1984
• a: 12.94 ± 0.003 Å
• b: 13.551 ± 0.003 Å
• c: 7.44 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1304.6 ± 0.5 ų
• Number of distinct elements: 4
• Hermann-Mauguin space group symbol: P n m n
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No