Information card for entry 4105227

Structure parameters

• Formula: C26 H41 F6 N O Os P2
• Calculated formula: C26 H41 F6 N O Os P2
• SMILES: [Os]12345([P](C(C)C)(C(C)C)C(C)C)([n]6c(C7C=1CC7)cccc6)[cH]1[cH]2[cH]3[cH]4[cH]51.[P](F)(F)(F)(F)(F)[F-].O=C(C)C
• Title of publication: Formation of Osmium- and Ruthenium-Cyclobutylidene Complexes by Ring Expansion of Alkylidenecyclopropanes
• Authors of publication: Ruth Castro-Rodrigo; Miguel A. Esteruelas; Sara Fuertes; Ana M. López; Fernando López; José L. Mascareñas; Silvia Mozo; Enrique Oñate; Lucía Saya; Lara Villarino
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 15572 - 15573
• a: 9.1653 ± 0.0011 Å
• b: 11.1937 ± 0.0013 Å
• c: 14.2705 ± 0.0017 Å
• α: 78.851 ± 0.002°
• β: 89.57 ± 0.002°
• γ: 89.34 ± 0.002°
• Cell volume: 1436.3 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0759
• Weighted residual factors for all reflections included in the refinement: 0.0781
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No