Information card for entry 7010650

Structure parameters

• Common name: VO(acac-NMe2)2
• Chemical name: Bis(N,N'-dimethylacetylacetamido)oxovanadium(IV)
• Formula: C18 H26 N2 O5 V
• Calculated formula: C18 H26 N2 O5 V
• SMILES: [V]12(=O)(OC(=CC(=[O]1)C)N(C)C)[O]=C(C=C(N(C)C)O2)C.c1ccccc1
• Title of publication: Bis(acetylamido)oxovanadium(IV) complexes: solid state and solution studies
• Authors of publication: Debbie C. Crans; A. Raza Khan; Mohammed Mahroof-Tahir; Sujit Mondal; Susie M. Miller; Agnete la Cour; Oren P. Anderson; Tamás Jakusch; Tamás Kiss
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2001
• Journal issue: 22
• Pages of publication: 3337 - 3345
• a: 7.005 ± 0.002 Å
• b: 19.61 ± 0.006 Å
• c: 14.601 ± 0.004 Å
• α: 90°
• β: 90.19 ± 0.02°
• γ: 90°
• Cell volume: 2005.7 ± 1 ų
• Cell temperature: 166 ± 2 K
• Ambient diffraction temperature: 166 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0887
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for all reflections: 0.1823
• Weighted residual factors for significantly intense reflections: 0.1604
• Goodness-of-fit parameter for all reflections: 1.04
• Goodness-of-fit parameter for significantly intense reflections: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No