Information card for entry 4029111

Structure parameters

• Formula: C28 H40 S4 Si4
• Calculated formula: C28 H40 S4 Si4
• Title of publication: Synthesis and characterization of cyclooctatetrathiophenes with different connection sequences.
• Authors of publication: Wang, Yong; Song, Jinsheng; Xu, Li; Kan, Yuhe; Shi, Jianwu; Wang, Hua
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2014
• Journal volume: 79
• Journal issue: 5
• Pages of publication: 2255 - 2262
• a: 10.31 ± 0.003 Å
• b: 12.9 ± 0.004 Å
• c: 27.078 ± 0.008 Å
• α: 90°
• β: 94.648 ± 0.007°
• γ: 90°
• Cell volume: 3589.5 ± 1.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.095
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1711
• Weighted residual factors for all reflections included in the refinement: 0.1873
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No