Information card for entry 7212922

Structure parameters

• Formula: C16 H8 S3
• Calculated formula: C16 H8 S3
• SMILES: s1c2ccccc2c2c1sc1sc3c(c21)cccc3
• Title of publication: Single crystal ribbons and transistors of a solution processed sickle-like fused-ring thienoacene
• Authors of publication: Li, Rongjin; Dong, Huanli; Zhan, Xiaowei; He, Yudong; Li, Hongxiang; Hu, Wenping
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2010
• Journal volume: 20
• Journal issue: 29
• Pages of publication: 6014
• a: 3.8834 ± 0.0008 Å
• b: 7.5943 ± 0.0015 Å
• c: 41.63 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1227.7 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0561
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for significantly intense reflections: 0.1053
• Weighted residual factors for all reflections included in the refinement: 0.1304
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No