Information card for entry 4114324

Structure parameters

• Formula: C18 H42 Cl2 O2 Os P2
• Calculated formula: C18 H42 Cl2 O2 Os P2
• SMILES: [P](C(C)C)(C(C)C)(C(C)C)[Os](Cl)(=O)([P](C(C)C)(C(C)C)C(C)C)(Cl)=O
• Title of publication: Dioxygen Activation by an Osmium-dihydride: Preparation and Characterization of a d4 Square-Planar Complex
• Authors of publication: Miguel A. Esteruelas; Francisco J. Modrego; Enrique Oñate; Eva Royo
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 13344 - 13345
• a: 8.0247 ± 0.0015 Å
• b: 9.0401 ± 0.0017 Å
• c: 16.608 ± 0.003 Å
• α: 90°
• β: 91.187 ± 0.003°
• γ: 90°
• Cell volume: 1204.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0714
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.103
• Weighted residual factors for all reflections included in the refinement: 0.1089
• Goodness-of-fit parameter for all reflections included in the refinement: 0.933
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No