Information card for entry 4307257

Structure parameters

• Chemical name: cis-Dichloro(dimethylsulfoxide)(bis(2-diphenylphosphino phenyl)ether)ruthenium(II) Dichloromethane solvate
• Formula: C41 H40 Cl8 O2 P2 Ru S
• Calculated formula: C41 H40 Cl8 O2 P2 Ru S
• SMILES: [Ru]12(Cl)(Cl)([S](=O)(C)C)[P](c3ccccc3)(c3ccccc3)c3ccccc3[O]2c2ccccc2[P]1(c1ccccc1)c1ccccc1.ClCCl.ClCCl.ClCCl
• Title of publication: Ruthenium(II) Complexes Containing Bis(2-(diphenylphosphino)phenyl) Ether and Their Catalytic Activity in Hydrogenation Reactions
• Authors of publication: Ramalingam Venkateswaran; Joel T. Mague; Maravanji S. Balakrishna
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 809 - 817
• a: 11.4515 ± 0.0009 Å
• b: 13.868 ± 0.001 Å
• c: 15.372 ± 0.001 Å
• α: 92.377 ± 0.001°
• β: 106.488 ± 0.001°
• γ: 96.296 ± 0.001°
• Cell volume: 2320 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0556
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1146
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No