Information card for entry 4089693

Structure parameters

• Formula: C96 H68.83 O6.41 Si4
• Calculated formula: C96 H68.828 O6.414 Si4
• Title of publication: Synthesis and High Solid-State Fluorescence of Cyclic Silole Derivatives
• Authors of publication: Cai, Yuanjing; Samedov, Kerim; Dolinar, Brian S.; Song, Zhegang; Tang, Ben Zhong; Zhang, Chaocan; West, Robert
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 34
• Journal issue: 1
• Pages of publication: 78
• a: 10.7401 ± 0.0002 Å
• b: 12.3839 ± 0.0002 Å
• c: 15.3414 ± 0.0002 Å
• α: 109.814 ± 0.0009°
• β: 107.068 ± 0.0009°
• γ: 90.9332 ± 0.001°
• Cell volume: 1819.86 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.059
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.1312
• Weighted residual factors for all reflections included in the refinement: 0.1385
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No