Information card for entry 4075661

Structure parameters

• Formula: C34 H59 Cl O Os P2 Sn
• Calculated formula: C34 H59 Cl O Os P2 Sn
• SMILES: [OsH2]1([Sn](Cl)(c2ccccc2)c2ccccc2)([P](C(C)C)(C(C)C)C(C)C)([P](C(C)C)(C(C)C)C(C)C)OC(=CC=1)C
• Title of publication: C(sp2)−H Activation of RCHE−py (E = CH, N) and RCHCHC(O)R‘ Substrates Promoted by a Highly Unsaturated Osmium−Monohydride Complex
• Authors of publication: Eguillor, Beatriz; Esteruelas, Miguel A.; Oliván, Montserrat; Oñate, Enrique
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 7
• Pages of publication: 1428
• a: 10.5516 ± 0.0008 Å
• b: 19.3519 ± 0.0014 Å
• c: 17.6856 ± 0.0013 Å
• α: 90°
• β: 94.708 ± 0.001°
• γ: 90°
• Cell volume: 3599.1 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0225
• Residual factor for significantly intense reflections: 0.0185
• Weighted residual factors for significantly intense reflections: 0.0373
• Weighted residual factors for all reflections included in the refinement: 0.038
• Goodness-of-fit parameter for all reflections included in the refinement: 0.944
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No