Information card for entry 4074289

Structure parameters

• Common name: Compound 2
• Formula: C77 H86 B Cl2 F24 Mo N O3
• Calculated formula: C77.007 H86.016 B Cl2 F24 Mo N O3
• Title of publication: Cationic Imido Alkylidene Complexes of Molybdenum Supported by β-Diketonate and β-Diketiminate Ligands
• Authors of publication: Tonzetich, Zachary J.; Jiang, Annie J.; Schrock, Richard R.; Müller, Peter
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 20
• Pages of publication: 4725
• a: 12.5398 ± 0.0003 Å
• b: 15.8864 ± 0.0004 Å
• c: 20.9492 ± 0.0005 Å
• α: 73.012 ± 0.001°
• β: 88.179 ± 0.001°
• γ: 80.249 ± 0.001°
• Cell volume: 3932.88 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0671
• Residual factor for significantly intense reflections: 0.0578
• Weighted residual factors for significantly intense reflections: 0.1673
• Weighted residual factors for all reflections included in the refinement: 0.1763
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No