Information card for entry 4115632

Structure parameters

• Common name: RuHCl(R-binap)(tmen)
• Formula: C50 H49 Cl N2 P2 Ru
• Calculated formula: C50 H49 Cl N2 P2 Ru
• Title of publication: Catalytic Cycle for the Asymmetric Hydrogenation of Prochiral Ketones to Chiral Alcohols: Direct Hydride and Proton Transfer from Chiral Catalysts trans-Ru(H)2(diphosphine)(diamine) to Ketones and Direct Addition of Dihydrogen to the Resulting Hydridoamido Complexes
• Authors of publication: Kamaluddin Abdur-Rashid; Michael Faatz; Alan J. Lough; Robert H. Morris
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2001
• Journal volume: 123
• Pages of publication: 7473 - 7474
• a: 11.196 ± 0.0008 Å
• b: 11.196 ± 0.0008 Å
• c: 72.929 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9141.7 ± 1 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0879
• Residual factor for significantly intense reflections: 0.0808
• Weighted residual factors for significantly intense reflections: 0.1749
• Weighted residual factors for all reflections included in the refinement: 0.1777
• Goodness-of-fit parameter for all reflections included in the refinement: 1.219
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No