Information card for entry 4069164

Structure parameters

• Formula: C75 H82.5 B F24 O2.75 Os P2
• Calculated formula: C75 H82.5 B F24 O2.75 Os P2
• Title of publication: Selectivity of Allenylidene versus Butadienyl Protonation in an Osmium−Bisphosphine System
• Authors of publication: Bolaño, Tamara; Collado, Alba; Esteruelas, Miguel A.; Oñate, Enrique
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 7
• Pages of publication: 2107
• a: 14.411 ± 0.004 Å
• b: 27.576 ± 0.008 Å
• c: 19.601 ± 0.006 Å
• α: 90°
• β: 94.223 ± 0.006°
• γ: 90°
• Cell volume: 7768 ± 4 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: 0.1115
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.1228
• Weighted residual factors for all reflections included in the refinement: 0.1402
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No