Information card for entry 2211372

Structure parameters

• Chemical name: 2,5-bis(2-cyano-2-thienylvinyl)thiophene
• Formula: C18 H10 N2 S3
• Calculated formula: C18 H10 N2 S3
• Title of publication: 2,5-Bis(2-cyano-2-thienylvinyl)thiophene
• Authors of publication: Wagner, Paweł; Officer, David L.; Kubicki, Maciej
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: o5931 - o5932
• a: 12.379 ± 0.002 Å
• b: 12.651 ± 0.002 Å
• c: 20.421 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3198.1 ± 1 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0566
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections included in the refinement: 0.0947
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes