Information card for entry 4121918

Structure parameters

• Formula: C21 H43 Mo P3 Si
• Calculated formula: C21 H43 Mo P3 Si
• SMILES: [MoH4]1([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)[SiH]([H]1)(c1ccccc1)c1ccccc1
• Title of publication: Si-H and Si-C Bond Cleavage Reactions of Silane and Phenylsilanes with Mo(PMe3)6: Silyl, Hypervalent Silyl, Silane, and Disilane Complexes.
• Authors of publication: Zuzek, Ashley A.; Parkin, Gerard
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 23
• Pages of publication: 8177 - 8180
• a: 9.5132 ± 0.0011 Å
• b: 9.3963 ± 0.0011 Å
• c: 29.385 ± 0.003 Å
• α: 90°
• β: 91.339 ± 0.002°
• γ: 90°
• Cell volume: 2626 ± 0.5 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0702
• Residual factor for significantly intense reflections: 0.0576
• Weighted residual factors for significantly intense reflections: 0.1161
• Weighted residual factors for all reflections included in the refinement: 0.1199
• Goodness-of-fit parameter for all reflections included in the refinement: 1.256
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No