Information card for entry 4081331

Structure parameters

• Formula: C55 H45 B F24 N Os P
• Calculated formula: C53.85 H43.35 B F23.997 N0.95 Os P
• Title of publication: Osmium Models of Intermediates Involved in Catalytic Reactions of Alkylidenecyclopropanes
• Authors of publication: Esteruelas, Miguel A.; López, Ana M.; López, Fernando; Mascareñas, José L.; Mozo, Silvia; Oñate, Enrique; Saya, Luc\?ía
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 17
• Pages of publication: 4851
• a: 33.789 ± 0.009 Å
• b: 12.687 ± 0.004 Å
• c: 12.974 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5562 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0989
• Residual factor for significantly intense reflections: 0.0788
• Weighted residual factors for significantly intense reflections: 0.2101
• Weighted residual factors for all reflections included in the refinement: 0.2244
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No