Information card for entry 4114909

Structure parameters

• Formula: C9 H27 Cl3 O10 P3 Rh
• Calculated formula: C9 H18 Cl3 O10 P3 Rh
• SMILES: [Rh](Cl)(Cl)(Cl)([P](CO)(CO)CO)([P](CO)(CO)CO)[P](CO)(CO)CO.O
• Title of publication: Exceptional Kinetic Propensity of Hydroxymethyl Phosphanes toward Rh(III) Stabilization in Water
• Authors of publication: Kannan Raghuraman; Nagavarakishore Pillarsetty; Wynn A. Volkert; Charles Barnes; Silvia Jurisson; Kattesh V. Katti
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 7276 - 7277
• a: 11.8195 ± 0.0008 Å
• b: 12.8382 ± 0.0008 Å
• c: 13.5007 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2048.6 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0741
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.1154
• Weighted residual factors for all reflections included in the refinement: 0.1248
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No