Information card for entry 2201274

Structure parameters

• Chemical name: hydridodichlorotris(methyldiphenylphosphine)rhodium(III) dichloromethane trisolvate
• Formula: C42 H46 Cl8 P3 Rh
• Calculated formula: C42 H46 Cl8 P3 Rh
• SMILES: [RhH](Cl)(Cl)([P](c1ccccc1)(c1ccccc1)C)([P](c1ccccc1)(c1ccccc1)C)[P](c1ccccc1)(c1ccccc1)C.C(Cl)Cl.C(Cl)Cl.C(Cl)Cl
• Title of publication: Hydridodichlorotris(methyldiphenylphosphine)rhodium(III) dichloromethane trisolvate
• Authors of publication: Clegg, William; Scott, Andrew J.; Norman, Nicholas C.; Robins, Edward G.; Whittell, George R.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 8
• Pages of publication: m408 - m409
• a: 12.5494 ± 0.0008 Å
• b: 18.3233 ± 0.0012 Å
• c: 20.0687 ± 0.0013 Å
• α: 90°
• β: 92.063 ± 0.002°
• γ: 90°
• Cell volume: 4611.7 ± 0.5 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.064
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.1024
• Weighted residual factors for all reflections included in the refinement: 0.118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes