Information card for entry 4065283

Structure parameters

• Formula: C58 H45 Cl5 O Os P2
• Calculated formula: C58 H45 Cl5 O Os P2
• SMILES: [Os]1(Cl)([Cl]c2c(C(=C1)c1c(Cl)cccc1Cl)c(Cl)ccc2)([P](c1ccccc1)(c1ccccc1)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)C#[O].c1(ccccc1)C
• Title of publication: Hydrolysis of Osmium and Ruthenium Carbyne Complexes
• Authors of publication: Chen, Jiangxi; Sung, Herman Ho-Yung; Williams, Ian Duncan; Jia, Guochen
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 22
• Pages of publication: 6159
• a: 10.262 ± 0.0008 Å
• b: 11.6363 ± 0.001 Å
• c: 23.4763 ± 0.0019 Å
• α: 76.4 ± 0.001°
• β: 79.088 ± 0.001°
• γ: 66.454 ± 0.001°
• Cell volume: 2483.5 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0249
• Residual factor for significantly intense reflections: 0.0232
• Weighted residual factors for significantly intense reflections: 0.0545
• Weighted residual factors for all reflections included in the refinement: 0.0551
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No