Information card for entry 4121923

Structure parameters

• Formula: C18 H48 Mo P4 Si2
• Calculated formula: C18 H48 Mo P4 Si2
• SMILES: [MoH2]([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)([SiH3])[SiH2]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: 15.8327 ± 0.001 Å
• b: 12.3924 ± 0.0008 Å
• c: 14.3996 ± 0.0009 Å
• α: 90°
• β: 101.111 ± 0.0009°
• γ: 90°
• Cell volume: 2772.3 ± 0.3 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: 0.0388
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.063
• Weighted residual factors for all reflections included in the refinement: 0.0685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No