Information card for entry 4080803

Structure parameters

• Formula: C44 H31 F15 Mo N3 O1.5
• Calculated formula: C44 H31 F15 Mo N3 O1.5
• Title of publication: Synthesis and ROMP Chemistry of Decafluoroterphenoxide Molybdenum Imido Alkylidene and Ethylene Complexes
• Authors of publication: Yuan, Jian; Schrock, Richard R.; Gerber, Laura C. H.; Müller, Peter; Smith, Stacey
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 10
• Pages of publication: 2983
• a: 11.9807 ± 0.0008 Å
• b: 16.7624 ± 0.0011 Å
• c: 22.1895 ± 0.0015 Å
• α: 96.267 ± 0.001°
• β: 105.508 ± 0.001°
• γ: 100.952 ± 0.001°
• Cell volume: 4155.1 ± 0.5 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: 0.0332
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0657
• Weighted residual factors for all reflections included in the refinement: 0.0693
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No