Information card for entry 2006241

Structure parameters

• Formula: C6 H12 N2 O6 V
• Calculated formula: C6 H10 N2 O6 V
• SMILES: [V]123([NH](CC[NH]1CC(=O)O2)CC(=O)O3)(=O)[OH2]
• Title of publication: Aqua(ethylenediamine-<i>N</i>,<i>N</i>'-diacetato-<i>O</i>,<i>O</i>')oxovanadium(IV)
• Authors of publication: Kan Kanamori; Kazuhito Ino; Ken-Ichi Okamoto
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 6
• Pages of publication: 672 - 673
• a: 8.307 ± 0.002 Å
• b: 6.7435 ± 0.0009 Å
• c: 10.102 ± 0.002 Å
• α: 90°
• β: 118.576 ± 0.006°
• γ: 90°
• Cell volume: 496.96 ± 0.17 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 5
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for significantly intense reflections: 0.0309
• Weighted residual factors for significantly intense reflections: 0.045
• Goodness-of-fit parameter for significantly intense reflections: 1.417
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No