Information card for entry 4310859

Structure parameters

• Formula: C44 H81 O8 P3 Pt3 Rh2
• Calculated formula: C44 H81 O8 P3 Pt3 Rh2
• SMILES: [Pt]123([Rh]4567([Pt]8([Rh]15(C6=O)(C8=O)(C#[O])(C1=O)(C2=O)[Pt]14([P](C(C)(C)C)(C(C)(C)C)C(C)(C)C)C7=O)[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C)(C#[O])C3=O)[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Platinum-Rhodium Carbonyl Clusters: New Structures and New Types of Dynamical Activity
• Authors of publication: Richard D. Adams; Burjor Captain; Perry J. Pellechia; Jack L. Smith
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 2695 - 2702
• a: 39.314 ± 0.003 Å
• b: 12.0693 ± 0.0009 Å
• c: 12.3772 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5872.9 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0729
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.0916
• Weighted residual factors for all reflections included in the refinement: 0.0999
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No