Information card for entry 4322251

Structure parameters

• Formula: C22 H41 Cl3 N P2 V
• Calculated formula: C22 H41 Cl3 N P2 V
• SMILES: [V]1(=Nc2c(cccc2C(C)C)C(C)C)(Cl)(Cl)(Cl)[P](CC[P]1(CC)CC)(CC)CC
• Title of publication: Synthesis, Structural Characterization, and MO Calculations of Vanadium Imido Complexes Containing Bidentate Phosphine Coligands
• Authors of publication: Francisco Montilla; Angeles Monge; Enrique Gutiérrez-Puebla; Antonio Pastor; Diego del Río; Norge Cruz Hernández; Javier Fernández Sanz; Agustín Galindo
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 4462 - 4466
• a: 14.7387 ± 0.0014 Å
• b: 10.6738 ± 0.001 Å
• c: 16.999 ± 0.003 Å
• α: 90°
• β: 90.954 ± 0.002°
• γ: 90°
• Cell volume: 2673.9 ± 0.6 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• 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: 0.0894
• Residual factor for significantly intense reflections: 0.0544
• Weighted residual factors for all reflections: 0.1175
• Weighted residual factors for significantly intense reflections: 0.1046
• Goodness-of-fit parameter for all reflections: 0.983
• Goodness-of-fit parameter for significantly intense reflections: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No