Information card for entry 1565017

Structure parameters

• Formula: C122.08 H165.06 B6 N8 Si4
• Calculated formula: C122 H166 B6 N8 Si4
• Title of publication: Isolation of a Planar 1,2-Dilithio-disilene and Its Conversion to Si−B Hybrid 2π-Electron System and a Planar Tetraboryldisilene
• Authors of publication: Tian, Miao; Zhang, Jianying; Guo, Lulu; Cui, Chunming
• Journal of publication: Chemical Science
• Year of publication: 2021
• a: 17.3657 ± 0.0005 Å
• b: 17.4514 ± 0.0005 Å
• c: 39.6637 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12020.3 ± 0.6 ų
• Cell temperature: 113.15 K
• Ambient diffraction temperature: 113.15 K
• Number of distinct elements: 5
• 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: 0.1088
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for significantly intense reflections: 0.1168
• Weighted residual factors for all reflections included in the refinement: 0.1348
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No