Information card for entry 4072846

Structure parameters

• Formula: C43 H63 Cl2 F N2 P Ru
• Calculated formula: C43 H63 Cl2 F N2 P Ru
• Title of publication: Synthesis, Structure, and Olefin Metathesis Activity of Two Ruthenium Monofluoromethylidene Complexes
• Authors of publication: Macnaughtan, Marisa L.; Johnson, Marc J. A.; Kampf, Jeff W.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 4
• Pages of publication: 780
• a: 11.7509 ± 0.0009 Å
• b: 21.2958 ± 0.0015 Å
• c: 17.7264 ± 0.0013 Å
• α: 90°
• β: 95.055 ± 0.004°
• γ: 90°
• Cell volume: 4418.7 ± 0.6 ų
• Cell temperature: 108 ± 2 K
• Ambient diffraction temperature: 108 ± 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: 0.0418
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1049
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No