Information card for entry 4321344

Structure parameters

• Formula: C8 H10 Cl2 N O2 V
• Calculated formula: C8 H10 Cl2 N O2 V
• SMILES: [V]1(Cl)(Cl)(=O)OC(c2[n]1cccc2)(C)C
• Title of publication: Vanadium(IV) and -(V) Complexes with O,N-Chelating Aminophenolate and Pyridylalkoxide Ligands
• Authors of publication: Henk Hagen; Chris Bezemer; Jaap Boersma; Huub Kooijman; Martin Lutz; Anthony L. Spek; Gerard van Koten
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 3970 - 3977
• a: 11.8576 ± 0.0012 Å
• b: 12.671 ± 0.0013 Å
• c: 14.722 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2211.9 ± 0.4 ų
• Cell temperature: 225 K
• Ambient diffraction temperature: 225 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0944
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1173
• Weighted residual factors for all reflections included in the refinement: 0.1378
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No