Information card for entry 4081329

Structure parameters

• Formula: C55 H45 B F24 N Os P
• Calculated formula: C53.39 H42.69 B F24.003 N0.93 Os P0.93
• 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: 16.417 ± 0.0018 Å
• b: 13.7633 ± 0.0015 Å
• c: 24.548 ± 0.003 Å
• α: 90°
• β: 104.371 ± 0.001°
• γ: 90°
• Cell volume: 5373.1 ± 1.1 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: 0.1309
• Residual factor for significantly intense reflections: 0.0917
• Weighted residual factors for significantly intense reflections: 0.1957
• Weighted residual factors for all reflections included in the refinement: 0.216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No