Information card for entry 4064233

Structure parameters

• Formula: C25 H54 Cl2 Os P2
• Calculated formula: C25 H54 Cl2 Os P2
• SMILES: [OsH](Cl)(Cl)([P](C(C)C)(C(C)C)C(C)C)([P](C(C)C)(C(C)C)C(C)C)#CC(=C\C(C)C)\C
• Title of publication: Hydride Alkenylcarbyne Osmium Complexes versus Cyclopentadienyl Type Half-Sandwich Ruthenium Derivatives
• Authors of publication: Collado, Alba; Esteruelas, Miguel A.; Oñate, Enrique
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 7
• Pages of publication: 1930
• a: 14.8549 ± 0.0008 Å
• b: 11.9049 ± 0.0006 Å
• c: 17.4551 ± 0.0009 Å
• α: 90°
• β: 101.612 ± 0.001°
• γ: 90°
• Cell volume: 3023.7 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0298
• Residual factor for significantly intense reflections: 0.0227
• Weighted residual factors for significantly intense reflections: 0.0492
• Weighted residual factors for all reflections included in the refinement: 0.0558
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No