Information card for entry 7239096

Structure parameters

• Formula: C27 H30 S2
• Calculated formula: C27 H30 S2
• Title of publication: A facile synthesis of dithieno[3,2-b:6,7-b]fluorenes via a tandem annulation‒reduction
• Authors of publication: Xiong, Xiaoli; Liu, Qiancai; Zhang, Jun; Zhu, Min; Wang, Yanmei; Deng, Shiming
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 39
• Pages of publication: 17707
• a: 7.6535 ± 0.0009 Å
• b: 11.5648 ± 0.0014 Å
• c: 13.8466 ± 0.0017 Å
• α: 67.639 ± 0.003°
• β: 84.037 ± 0.004°
• γ: 81.169 ± 0.004°
• Cell volume: 1118.6 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0492
• Residual factor for significantly intense reflections: 0.0357
• Weighted residual factors for significantly intense reflections: 0.0908
• Weighted residual factors for all reflections included in the refinement: 0.1006
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No