Information card for entry 2103792

Structure parameters

• Chemical name: (2-Hydroxyethanolato)-oxo-(N-(1-oxy-2-methylprop-2-yl)-2-oxy-1-naphthaldimato)- -vanadium(v)
• Formula: C17 H20 N O5 V
• Calculated formula: C17 H20 N O5 V
• SMILES: [V]123(=O)(OCC([N]3=Cc3c(O1)ccc1ccccc31)(C)C)[OH]CCO2
• Title of publication: 22 Space-group changes
• Authors of publication: Clemente, Dore Augusto; Marzotto, Armando
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 1
• Pages of publication: 43 - 50
• a: 9.717 ± 0.008 Å
• b: 9.717 ± 0.008 Å
• c: 18.217 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1720 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 78
• Hermann-Mauguin space group symbol: P 43
• Hall space group symbol: P 4cw
• Residual factor for all reflections: 0.0077
• Residual factor for significantly intense reflections: 0.0076
• Weighted residual factors for significantly intense reflections: 0.0298
• Weighted residual factors for all reflections included in the refinement: 0.0306
• Goodness-of-fit parameter for all reflections included in the refinement: 0.178
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No