Information card for entry 1573788

Structure parameters

• Formula: C31 H48 B Cl3 N2 O P Si
• Calculated formula: C31 H48 B Cl3 N2 O P Si
• Title of publication: A silicon analogue of a fused bicyclic borirene derivative.
• Authors of publication: Phang, Si Jia Isabel; Zhang, Zheng-Feng; Wu, Chi-Shiun; Wong, Zhen Xuan; Su, Ming-Der; So, Cheuk-Wai
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 10
• Pages of publication: 4512 - 4518
• a: 11.1528 ± 0.0002 Å
• b: 22.0855 ± 0.0005 Å
• c: 27.2759 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6718.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.0499
• Residual factor for significantly intense reflections: 0.0402
• Weighted residual factors for significantly intense reflections: 0.0906
• Weighted residual factors for all reflections included in the refinement: 0.095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No