Information card for entry 4112480

Structure parameters

• Formula: C30 H27 O17 P Pt Ru6
• Calculated formula: C30 H27 O17 P Pt Ru6
• SMILES: [Pt]123([Ru]4567([Ru]89%10([Ru]%11%12%131([Ru]1%14%158([Ru]849([Ru]25%111([C]6%10%12%148)(C#[O])(C#[O])C3=O)(C7=O)(C%15=O)(C#[O])C#[O])(C%13=O)(C#[O])C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])C#[O])[P](C(C)(C)C)(C(C)(C)C)C(C)(C)C
• Title of publication: Bimetallic Cluster Complexes: The Synthesis, Structures, and Bonding of Ruthenium Carbonyl Cluster Complexes Containing Palladium and Platinum with the Bulky Tri-tert-butyl-phosphine Ligand
• Authors of publication: Richard D. Adams; Burjor Captain; Wei Fu; Michael B. Hall; Josiah Manson; Mark D. Smith; Charles Edwin Webster
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2004
• Journal volume: 126
• Pages of publication: 5253 - 5267
• a: 12.2489 ± 0.0005 Å
• b: 19.8587 ± 0.0008 Å
• c: 16.457 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4003.1 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0417
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.059
• Weighted residual factors for all reflections included in the refinement: 0.0614
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No