Information card for entry 2201088

Structure parameters

• Chemical name: Bis(tetrabutylammonium) bis(malonato)oxovanadate(IV)
• Formula: C38 H76 N2 O9 V
• Calculated formula: C38 H76 N2 O9 V
• Title of publication: Bis(tetrabutylammonium) bis(malonato)oxovanadate(IV)
• Authors of publication: Therrien, Bruno; Stanislas, Sandrine; Stoeckli-Evans, Helen; Shul'pin, Georgiy B.; Süss-Fink, Georg
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 5
• Pages of publication: m215 - m216
• a: 9.6847 ± 0.0009 Å
• b: 13.3123 ± 0.0013 Å
• c: 17.1221 ± 0.0015 Å
• α: 92.613 ± 0.011°
• β: 90.303 ± 0.011°
• γ: 95.348 ± 0.011°
• Cell volume: 2195.5 ± 0.4 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.145
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for significantly intense reflections: 0.159
• Weighted residual factors for all reflections included in the refinement: 0.183
• Goodness-of-fit parameter for all reflections included in the refinement: 0.76
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes