Information card for entry 4313371

Structure parameters

• Formula: C28 H27 O15 P Pt Ru5
• Calculated formula: C28 H27 O15 P Pt Ru5
• SMILES: [Pt]12([Ru]3456([Ru]78([Ru]9%10([Ru]%115([Ru]679([C]138%10%11)(C#[O])(C#[O])C4=O)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C2=O)[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Remarkable Dynamical Opening and Closing of Platinum and Palladium Pentaruthenium Carbido Carbonyl Cluster Complexes
• Authors of publication: Richard D. Adams; Burjor Captain; Wei Fu; Perry J. Pellechia; Mark D. Smith
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 2094 - 2101
• a: 12.4684 ± 0.001 Å
• b: 17.9669 ± 0.0015 Å
• c: 17.3482 ± 0.0014 Å
• α: 90°
• β: 107.613 ± 0.002°
• γ: 90°
• Cell volume: 3704.1 ± 0.5 ų
• Cell temperature: 190 ± 2 K
• Ambient diffraction temperature: 190 ± 2 K
• Number of distinct elements: 6
• 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: 0.0565
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1034
• Goodness-of-fit parameter for all reflections included in the refinement: 1.105
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No