Information card for entry 4076703

Structure parameters

• Formula: C48 H36 O9 Os3 P Sb
• Calculated formula: C48 H36 O9 Os3 P Sb
• SMILES: [Os]1([H][Os]([Sb]([Os](C#[O])(C#[O])(C#[O])C#[O])(c2ccccc2)c2ccccc2)(C#[O])(C#[O])(C#[O])c2c1cccc2)([P](c1ccc(cc1)C)(c1ccc(cc1)C)c1ccc(cc1)C)(C#[O])C#[O]
• Title of publication: Nucleophilic Addition Reactions of the Osmium−Antimony Cluster (μ-H)Os3(CO)9(μ3-C6H4)(μ-SbPh2): Orthometalation of Triphenylphosphine at Ambient Temperature
• Authors of publication: Chen, Guizhu; Deng, Mingli; Lee, Chee Keong; Leong, Weng Kee
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Journal issue: 6
• Pages of publication: 1227
• a: 13.7183 ± 0.0002 Å
• b: 17.4565 ± 0.0003 Å
• c: 20.1485 ± 0.0002 Å
• α: 90°
• β: 102.507 ± 0.001°
• γ: 90°
• Cell volume: 4710.53 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0689
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0698
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No