Information card for entry 4086419

Structure parameters

• Formula: C51.5 H61 F5 Mo N2 O2
• Calculated formula: C51.5 H61 F5 Mo N2 O2
• Title of publication: Molybdenum and Tungsten Alkylidene and Metallacyclobutane Complexes That Contain a Dianionic Biphenolate Pincer Ligand
• Authors of publication: Sues, Peter E.; John, Jeremy M.; Schrock, Richard R.; Müller, Peter
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 5
• Pages of publication: 758
• a: 34.326 ± 0.011 Å
• b: 16.556 ± 0.006 Å
• c: 17.67 ± 0.006 Å
• α: 90°
• β: 114.468 ± 0.005°
• γ: 90°
• Cell volume: 9140 ± 5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0556
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for significantly intense reflections: 0.0973
• Weighted residual factors for all reflections included in the refinement: 0.1069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No