Information card for entry 7027984

Structure parameters

• Formula: C21 H10 O11 Os3 Ru2
• Calculated formula: C21 H10 O11 Os3 Ru2
• SMILES: [C]12(=O)[Os]345(C#[O])([Os]6(C#[O])(C#[O])([Ru]789%10%11%1224([cH]2[cH]7[cH]%10[cH]%11[cH]92)[Ru]2479%1013([C]8(=O)[Os]56%12%10(C#[O])(C#[O])C#[O])[cH]1[cH]2[cH]7[cH]9[cH]41)C#[O])(C#[O])C#[O]
• Title of publication: Use of the monocationic fragment [Ru(η5-C5H5)(MeCN)3]+ as a capping reagent in the synthesis of mixed-metal clusters: synthesis and structural characterisation of [Os3RuH(CO)11(η5-C5H5)] and [Os3Ru2(CO)9(μ3-CO)2(η5-C5H5)2]
• Authors of publication: Buntem, Radchada; Lewis, Jack; Morewood, Catherine A.; Raithby, Paul R.; Ramirez de Arellano, M. Carmen; Shields, Gregory P.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 7
• Pages of publication: 1091
• a: 9.678 ± 0.003 Å
• b: 12.117 ± 0.005 Å
• c: 10.497 ± 0.003 Å
• α: 90°
• β: 93.59 ± 0.02°
• γ: 90°
• Cell volume: 1228.6 ± 0.7 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.0766
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for all reflections: 0.1991
• Weighted residual factors for significantly intense reflections: 0.1865
• Goodness-of-fit parameter for all reflections: 1.071
• Goodness-of-fit parameter for significantly intense reflections: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No