Information card for entry 4064192

Structure parameters

• Formula: C37.5 H64.5 B Cl F4 N2 O1.25 Os P2
• Calculated formula: C37.5 H61 B Cl F4 N2 O1.25 Os P2
• Title of publication: Osmium NHC Complexes from Alcohol-Functionalized Imidazoles and Imidazolium Salts
• Authors of publication: Eguillor, Beatriz; Esteruelas, Miguel A.; García-Raboso, Jorge; Oliván, Montserrat; Oñate, Enrique; Pastor, Isidro M.; Peñafiel, Itziar; Yus, Miguel
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 6
• Pages of publication: 1658
• a: 11.352 ± 0.003 Å
• b: 13.48 ± 0.004 Å
• c: 15.209 ± 0.004 Å
• α: 75.175 ± 0.005°
• β: 80.377 ± 0.005°
• γ: 74.714 ± 0.004°
• Cell volume: 2157.8 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0447
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0575
• Weighted residual factors for all reflections included in the refinement: 0.0595
• Goodness-of-fit parameter for all reflections included in the refinement: 0.845
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No