Information card for entry 4127651

Structure parameters

• Chemical name: 1
• Formula: C34 H33 F6 Mo N O2
• Calculated formula: C34 H33 F6 Mo N O2
• Title of publication: Noncovalent Interactions Drive the Efficiency of Molybdenum Imido Alkylidene Catalysts for Olefin Metathesis.
• Authors of publication: Ferreira, Marco A. B.; De Jesus Silva, Jordan; Grosslight, Samantha; Fedorov, Alexey; Sigman, Matthew S.; Copéret, Christophe
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 27
• Pages of publication: 10788 - 10800
• a: 10.9883 ± 0.0008 Å
• b: 12.4073 ± 0.0009 Å
• c: 12.6777 ± 0.001 Å
• α: 108.158 ± 0.002°
• β: 99.978 ± 0.003°
• γ: 105.441 ± 0.003°
• Cell volume: 1519.8 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0804
• Residual factor for significantly intense reflections: 0.0698
• Weighted residual factors for significantly intense reflections: 0.2034
• Weighted residual factors for all reflections included in the refinement: 0.2108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.104
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No