Information card for entry 7102167

Structure parameters

• Formula: C42 H44 P2 Ru Si2
• Calculated formula: C42 H44 P2 Ru Si2
• Title of publication: Agostic Si-H bond coordination assists C-H bond activation at ruthenium in bis(phosphinobenzylsilane) complexes.
• Authors of publication: Montiel-Palma, Virginia; Muñoz-Hernández, Miguel A; Ayed, Tahra; Barthelat, Jean-Claude; Grellier, Mary; Vendier, Laure; Sabo-Etienne, Sylviane
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 38
• Pages of publication: 3963 - 3965
• a: 19.0896 ± 0.0016 Å
• b: 11.1892 ± 0.001 Å
• c: 19.3721 ± 0.0016 Å
• α: 90°
• β: 115.559 ± 0.008°
• γ: 90°
• Cell volume: 3732.9 ± 0.6 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 100 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: 0.0998
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.0716
• Weighted residual factors for all reflections included in the refinement: 0.0844
• Goodness-of-fit parameter for all reflections included in the refinement: 0.835
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No