Information card for entry 7009765

Structure parameters

• Formula: C33 H40 Cl2 N P Ru
• Calculated formula: C33 H40 Cl2 N P Ru
• SMILES: [Ru]12345(Cl)(Cl)([P](c6ccccc6)(c6ccccc6)C[C@@H](N(C)C)Cc6ccccc6)[c]6([cH]5[cH]4[c]3([cH]2[cH]16)C)C(C)C
• Title of publication: (η6-Arene)ruthenium(II) complexes containing enantiomerically pure (β-aminoalkyl)phosphines or a (β-aminoalkyl) phosphinite: synthesis, stereochemical and kinetic studies
• Authors of publication: Arena, Carmela G.; Calamia, Stefania; Faraone, Felice; Graiff, Claudia; Tiripicchio, Antonio
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 18
• Pages of publication: 3149
• a: 17.149 ± 0.005 Å
• b: 17.903 ± 0.005 Å
• c: 10.066 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3090.4 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0519
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0551
• Weighted residual factors for all reflections included in the refinement: 0.0603
• Goodness-of-fit parameter for all reflections included in the refinement: 0.868
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No