Information card for entry 7004893

Structure parameters

• Common name: Ethoxo(2-oxo-benzaldehyde 2S-(2-tert-butylethoxo) imine)oxovanadium(V)
• Formula: C15 H22 N O4 V
• Calculated formula: C15 H22 N O4 V
• SMILES: [V]12([N]([C@H](CO1)C(C)(C)C)=Cc1ccccc1O2)(OCC)=O
• Title of publication: Synthesis, characterization, and structures of oxovanadium(V) complexes of Schiff bases of beta-amino alcohols as tunable catalysts for the asymmetric oxidation of organic sulfides and asymmetric alkynylation of aldehydes.
• Authors of publication: Hsieh, Sheng-Hsiung; Kuo, Ya-Pei; Gau, Han-Mou
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 1
• Pages of publication: 97 - 106
• a: 8.2505 ± 0.0007 Å
• b: 11.0013 ± 0.001 Å
• c: 9.4013 ± 0.0008 Å
• α: 90°
• β: 109.72 ± 0.002°
• γ: 90°
• Cell volume: 803.28 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0273
• Residual factor for significantly intense reflections: 0.0265
• Weighted residual factors for significantly intense reflections: 0.0733
• Weighted residual factors for all reflections included in the refinement: 0.0739
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No