Information card for entry 7237040

Structure parameters

• Chemical name: DVFBT
• Formula: C26 H26 Br2 N2 S3
• Calculated formula: C26 H26 Br2 N2 S3
• Title of publication: A vinyl flanked difluorobenzothiadiazole–dithiophene conjugated polymer for high performance organic field-effect transistors
• Authors of publication: Liang, Xianfeng; Sun, Wandong; Chen, Yanlin; Tan, Luxi; Cai, Zhengxu; Liu, Zitong; Wang, Lin; Li, Jing; Chen, Wei; Dong, Lichun
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 7
• Pages of publication: 1774
• a: 8.798 ± 0.0015 Å
• b: 13.21 ± 0.003 Å
• c: 13.288 ± 0.002 Å
• α: 113.098 ± 0.014°
• β: 104.841 ± 0.014°
• γ: 97.14 ± 0.014°
• Cell volume: 1328.6 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0773
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for significantly intense reflections: 0.1903
• Weighted residual factors for all reflections included in the refinement: 0.1953
• Goodness-of-fit parameter for all reflections included in the refinement: 1.262
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No