Information card for entry 4064861

Structure parameters

• Formula: C22 H47 N Os P2
• Calculated formula: C22 H47 N Os P2
• SMILES: [OsH]1234([P](C(C)C)(C(C)C)C(C)C)([P](C(C)C)(C(C)C)C(C)C)[cH]5[cH]4[cH]3[n]2[cH]15
• Title of publication: Preparation of Half-Sandwich Osmium Complexes by Deprotonation of Aromatic and Pro-aromatic Acids with a Hexahydride Brønsted Base
• Authors of publication: Esteruelas, Miguel A.; García-Raboso, Jorge; Oliván, Montserrat
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 14
• Pages of publication: 3844
• a: 12.589 ± 0.004 Å
• b: 11.559 ± 0.004 Å
• c: 16.492 ± 0.006 Å
• α: 90°
• β: 96.38 ± 0.006°
• γ: 90°
• Cell volume: 2385 ± 1.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0628
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No