Information card for entry 7005896

Structure parameters

• Formula: C7 H18 Cl O7 P2 Rh
• Calculated formula: C7 H18 Cl O7 P2 Rh
• SMILES: C(O)[P](CO)(CO)[Rh](C#[O])([P](CO)(CO)CO)Cl
• Title of publication: Synthesis and X-ray structures of water-soluble tris(hydroxymethyl)phosphine complexes of rhodium(I).
• Authors of publication: Lorenzini, Fabio; Patrick, Brian O.; James, Brian R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 30
• Pages of publication: 3224 - 3226
• a: 6.1225 ± 0.0007 Å
• b: 7.656 ± 0.001 Å
• c: 15.582 ± 0.002 Å
• α: 90.676 ± 0.005°
• β: 91.539 ± 0.005°
• γ: 98.235 ± 0.005°
• Cell volume: 722.51 ± 0.16 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0454
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.1145
• Weighted residual factors for all reflections included in the refinement: 0.1222
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No