Information card for entry 4076617

Structure parameters

• Formula: C38 H22 Au O10 Os3 P
• Calculated formula: C38 H22 Au O10 Os3 P
• SMILES: [Au]1([Os]23([Os]41([Os]2(C#[O])(C#[O])(C#[O])C#[O])([C]13C=Cc2c([CH]4=1)cccc2)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])[P](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis and Transformations of Triosmium Carbonyl Cluster Complexes Containing Bridging Aryl Ligands
• Authors of publication: Adams, Richard D.; Rassolov, Vitaly; Zhang, Qiang
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 8
• Pages of publication: 2961
• a: 30.52 ± 0.003 Å
• b: 10.1912 ± 0.0008 Å
• c: 27.194 ± 0.003 Å
• α: 90°
• β: 115.246 ± 0.004°
• γ: 90°
• Cell volume: 7650.4 ± 1.3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0611
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.0986
• Weighted residual factors for all reflections included in the refinement: 0.1073
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 4078180
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No