Information card for entry 4120124

Structure parameters

• Formula: C67 H64 B F N P3 Ru Si
• Calculated formula: C67 H64 B F N P3 Ru Si
• Title of publication: Silane-Isocyanide Coupling Involving 1,1-Insertion of XylNC into the Si-H Bond of a σ-Silane Ligand
• Authors of publication: Mark C. Lipke; T. Don Tilley
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 10298 - 10301
• a: 13.1029 ± 0.0011 Å
• b: 13.4322 ± 0.001 Å
• c: 17.4919 ± 0.0012 Å
• α: 75.37 ± 0.003°
• β: 84.383 ± 0.004°
• γ: 70.341 ± 0.003°
• Cell volume: 2804.9 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0632
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.1049
• Weighted residual factors for all reflections included in the refinement: 0.1149
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No