Information card for entry 4113864

Structure parameters

• Formula: C12 H39 P3 Ru Si
• Calculated formula: C12 H39 P3 Ru Si
• SMILES: [RuH3]([Si](C)(C)C)([P](C)(C)C)([P](C)(C)C)[P](C)(C)C
• Title of publication: Synthesis and Reactivity of Silyl Ruthenium Complexes: The Importance of Trans Effects in C-H Activation, Si-C Bond Formation, and Dehydrogenative Coupling of Silanes
• Authors of publication: Vladimir K. Dioumaev; Leo J. Procopio; Patrick J. Carroll; Donald H. Berry
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 8043 - 8058
• a: 14.22 ± 0.001 Å
• b: 9.802 ± 0.003 Å
• c: 16.265 ± 0.004 Å
• α: 90°
• β: 96.67 ± 0.01°
• γ: 90°
• Cell volume: 2251.7 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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 significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.039
• Goodness-of-fit parameter for significantly intense reflections: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No