Information card for entry 2007946

Structure parameters

• Common name: vanadyl mésopentafluorophenylporphyrine
• Chemical name: [(5,10,15,20-tetrapentafluorophenylporphyrinato)-oxo-vanadium(IV)] dichloromethane solvate
• Formula: C45 H10 Cl2 F20 N4 O V
• Calculated formula: C45 H10 Cl2 F20 N4 O V
• Title of publication: Vanadyl Tetrakis(pentafluorophenyl)porphyrin Dichloromethane Solvate
• Authors of publication: Duval, Hugues; Bulach, Véronique; Fischer, Jean; Weiss, Raymond
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 12
• Pages of publication: 1781 - 1784
• a: 14.07 ± 0.002 Å
• b: 11.328 ± 0.002 Å
• c: 26.375 ± 0.003 Å
• α: 90°
• β: 101.458 ± 0.009°
• γ: 90°
• Cell volume: 4120 ± 1.1 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.084
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for all reflections: 0.105
• Weighted residual factors for all reflections included in the refinement: 0.072
• Goodness-of-fit parameter for all reflections: 2.108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.479
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No