Information card for entry 4133325

Structure parameters

• Formula: C44 H40 F36 Mo2 O11
• Calculated formula: C44 H40 F36 Mo2 O11
• Title of publication: Syntheses of Molybdenum Oxo Benzylidene Complexes.
• Authors of publication: Zhai, Feng; Bukhryakov, Konstantin V.; Schrock, Richard R.; Hoveyda, Amir H.; Tsay, Charlene; Müller, Peter
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 42
• Pages of publication: 13609 - 13613
• a: 21.5299 ± 0.0019 Å
• b: 23.117 ± 0.002 Å
• c: 11.3996 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5673.7 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0533
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.1105
• Weighted residual factors for all reflections included in the refinement: 0.1134
• Goodness-of-fit parameter for all reflections included in the refinement: 1.13
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No