Information card for entry 7122860

Structure parameters

• Formula: C42 H25 B F15 O P Si
• Calculated formula: C42 H25 B F15 O P Si
• Title of publication: A self-hydrosilylation of phosphanylhydrosilylalkynes promoted by B(C6F5)3? An experimental and mechanistic study
• Authors of publication: Huang, Yanting; Wang, Xiaoping; Li, Yan; Yang, Ming-Chung; Su, Ming-Der; Zhu, Hongping
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 36.7083 ± 0.0008 Å
• b: 11.2563 ± 0.0002 Å
• c: 18.6415 ± 0.0004 Å
• α: 90°
• β: 98.69 ± 0.002°
• γ: 90°
• Cell volume: 7614.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0349
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0855
• Weighted residual factors for all reflections included in the refinement: 0.0883
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No