Information card for entry 4064508

Structure parameters

• Formula: C56 H55 N2 O1.5 W
• Calculated formula: C56 H55 N2 O1.5 W
• Title of publication: Room Temperature Z-Selective Homocoupling of α Olefins by Tungsten Catalysts.
• Authors of publication: Marinescu, Smaranda C.; Schrock, Richard R.; Müller, Peter; Takase, Michael K.; Hoveyda, Amir H.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 7
• Pages of publication: 1780 - 1782
• a: 44.1194 ± 0.0007 Å
• b: 9.5497 ± 0.0002 Å
• c: 23.8428 ± 0.0004 Å
• α: 90°
• β: 115.104 ± 0.001°
• γ: 90°
• Cell volume: 9096.7 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0233
• Residual factor for significantly intense reflections: 0.0219
• Weighted residual factors for significantly intense reflections: 0.0544
• Weighted residual factors for all reflections included in the refinement: 0.0553
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No