Information card for entry 4080676

Structure parameters

• Formula: C23 H53 Cl Os P2
• Calculated formula: C23 H53 Cl Os P2
• SMILES: [OsH2](Cl)([P](C(C)C)(C(C)C)C(C)C)([P](C(C)C)(C(C)C)C(C)C)C(=C(C)C)C
• Title of publication: Hydroosmiation of Allenes and Reductive Elimination of Olefin in Unsaturated Osmium(IV) Polyhydrides: Hydride versus Chloride
• Authors of publication: Esteruelas, Miguel A.; Larramona, Carmen; Oñate, Enrique
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 9
• Pages of publication: 2567
• a: 13.6944 ± 0.0012 Å
• b: 8.5307 ± 0.0008 Å
• c: 23.958 ± 0.002 Å
• α: 90°
• β: 96.831 ± 0.001°
• γ: 90°
• Cell volume: 2779 ± 0.4 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: 0.0289
• Residual factor for significantly intense reflections: 0.0211
• Weighted residual factors for significantly intense reflections: 0.0479
• Weighted residual factors for all reflections included in the refinement: 0.0507
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No