Information card for entry 4321439

Structure parameters

• Common name: [OsCl(O2)(dcpe)2]BPh4
• Formula: C77 H118 B Cl3 O2 Os P4
• Calculated formula: C77 H107 B Cl3 O2 Os P4
• Title of publication: Oxo Complexes of Osmium(IV) Formed via Dioxygen Activation. X-ray Structures of [OsX(dcpe)2]PF6 (X = Cl, Br), [OsCl(η2-O2)(dcpe)2]BPh4, and [OsCl(O)(dcpe)2]BPh4 (dcpe = 1,2-Bis(dicyclohexylphosphino)ethane)
• Authors of publication: Peter Barthazy; Michael Wörle; Heinz Rüegger; Antonio Mezzetti
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 4903 - 4912
• a: 23.585 ± 0.004 Å
• b: 12.764 ± 0.002 Å
• c: 25.587 ± 0.004 Å
• α: 90°
• β: 103.988 ± 0.001°
• γ: 90°
• Cell volume: 7474 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0869
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for all reflections: 0.1181
• Weighted residual factors for significantly intense reflections: 0.0999
• Goodness-of-fit parameter for all reflections: 0.973
• Goodness-of-fit parameter for significantly intense reflections: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No