Information card for entry 7010944

Structure parameters

• Formula: C23 H12 O14 Pt Ru5
• Calculated formula: C23 H12 O14 Pt Ru5
• SMILES: [Pt]1234567([Ru]89%10([Ru]%11%12%131([Ru]1%148([Ru]8%1529([Ru]3%111([C]4%10%12%148)(C%13=O)(C%15=O)(C#[O])C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])[CH]1=[CH]5CC[CH]6=[CH]7CC1
• Title of publication: High yield synthesis of Ru–Pt mixed-metal cluster compounds
• Authors of publication: Hermans, Sophie; Khimyak, Tetyana; Johnson, Brian F. G.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2001
• Journal issue: 22
• Pages of publication: 3295
• a: 17.302 ± 0.004 Å
• b: 17.302 ± 0.004 Å
• c: 38.128 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11414 ± 4 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0768
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for all reflections: 0.1101
• Weighted residual factors for significantly intense reflections: 0.0937
• Goodness-of-fit parameter for all reflections: 0.694
• Goodness-of-fit parameter for significantly intense reflections: 0.826
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No