Information card for entry 4101793

Structure parameters

• Formula: C23 H41 B2 F4 N6 O Os P
• Calculated formula: C23 H41 B2 F4 N6 O Os P
• SMILES: [Os]123([P](C(C)C)(C(C)C)C(C)C)([n]4n(ccc4)[BH](n4[n]1ccc4)n1[n]2ccc1)([O]=C(C)C)[CH2]=[CH2]3.[B](F)(F)(F)[F-]
• Title of publication: Cleavage of Both C(sp3)-C(sp2) Bonds of Alkylidenecyclopropanes: Formation of Ethylene-Osmium-Vinylidene Complexes
• Authors of publication: Ruth Castro-Rodrigo; Miguel A. Esteruelas; Ana M. López; Fernando López; José L. Mascareñas; Montserrat Oliván; Enrique Oñate; Lucía Saya; Lara Villarino
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 454 - 455
• a: 10.832 ± 0.003 Å
• b: 16.129 ± 0.005 Å
• c: 16.28 ± 0.005 Å
• α: 90°
• β: 97.185 ± 0.005°
• γ: 90°
• Cell volume: 2821.9 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.0517
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0485
• Weighted residual factors for all reflections included in the refinement: 0.0514
• Goodness-of-fit parameter for all reflections included in the refinement: 0.838
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No