Information card for entry 4107271

Structure parameters

• Formula: C49 H70 Cl O2 P W
• Calculated formula: C49 H70 Cl O2 P W
• Title of publication: Z-Selective Olefin Metathesis Reactions Promoted by Tungsten Oxo Alkylidene Complexes
• Authors of publication: Dmitry V. Peryshkov; Richard R. Schrock; Michael K. Takase; Peter Müller; Amir H. Hoveyda
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 20754 - 20757
• a: 22.6931 ± 0.0016 Å
• b: 8.9674 ± 0.0006 Å
• c: 23.7379 ± 0.0017 Å
• α: 90°
• β: 104.285 ± 0.001°
• γ: 90°
• Cell volume: 4681.3 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0264
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for significantly intense reflections: 0.0403
• Weighted residual factors for all reflections included in the refinement: 0.0422
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No