Information card for entry 2202538

Structure parameters

• Formula: C8 H16 N2 O10 V
• Calculated formula: C8 H16 N2 O10 V
• SMILES: C1(=O)O[V]2([OH2])(OC(=O)CC(=O)O2)(OC(=O)C1)=O.C([NH3+])C[NH3+]
• Title of publication: Ethylenediammonium aquabis(malonato)oxovanadate(IV)
• Authors of publication: Kaludjerović, Goran N.; Heinemann, Frank W.; Leovac, Vukadin M.; Trifunović, Srećko R.; Sabo, Tibor J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 7
• Pages of publication: m541 - m542
• a: 14.579 ± 0.002 Å
• b: 11.866 ± 0.001 Å
• c: 8.758 ± 0.002 Å
• α: 90°
• β: 123.13 ± 0.01°
• γ: 90°
• Cell volume: 1268.8 ± 0.4 ų
• Cell temperature: 210 ± 2 K
• Ambient diffraction temperature: 210 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0275
• Residual factor for significantly intense reflections: 0.0253
• Weighted residual factors for significantly intense reflections: 0.0646
• Weighted residual factors for all reflections included in the refinement: 0.066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes