Information card for entry 2204327

Structure parameters

• Common name: [N,N'-dimethylethylenediamine(salicylaldehyde)]oxovanadium(V)
• Chemical name: {2-[2-(N,N'-dimethylamino)ethyliminomethyl]phenolato- κ^3^N,N',O}dioxovanadium(V)
• Formula: C11 H15 N2 O3 V
• Calculated formula: C11 H15 N2 O3 V
• SMILES: [V]12(Oc3ccccc3C=[N]1CC[N]2(C)C)(=O)=O
• Title of publication: {2-[2-(<i>N</i>,<i>N</i>'-Dimethylamino)ethyliminomethyl]phenolato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>}dioxovanadium(V)
• Authors of publication: Ming-Jin, Xie; Shi Ping, Yan; Dai Zheng, Liao; Zong Hui, Jian; Peng, Chen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 10
• Pages of publication: m1382 - m1383
• a: 6.325 ± 0.0019 Å
• b: 15.945 ± 0.005 Å
• c: 11.995 ± 0.004 Å
• α: 90°
• β: 90.645 ± 0.005°
• γ: 90°
• Cell volume: 1209.6 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0461
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0908
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes