Information card for entry 8105448

Structure parameters

• Formula: C16 H24 N8 O5 S V
• Calculated formula: C16 H24 N8 O5 S V
• SMILES: [V](=O)(OS(=O)(=O)[O-])([n]1cn(C)cc1)([n]1cn(C)cc1)([n]1cn(C)cc1)[n]1cn(C)cc1
• Title of publication: The crystal structure of tetrakis(1-methylimidazole-κ1 N)-oxido-(sulfato-κ1 O)vanadium(IV), C16H24N8O5SV
• Authors of publication: Zhang, Gang; Luan, Jian; Wang, Xiao-Jie
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 6
• Pages of publication: 1295 - 1296
• a: 9.6165 ± 0.0006 Å
• b: 16.6705 ± 0.001 Å
• c: 15.2726 ± 0.0007 Å
• α: 90°
• β: 121.63 ± 0.003°
• γ: 90°
• Cell volume: 2084.7 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0521
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.1184
• Weighted residual factors for all reflections included in the refinement: 0.1443
• Goodness-of-fit parameter for all reflections included in the refinement: 1.179
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No