Information card for entry 7708176

Structure parameters

• Common name: K3V3O3(pgal)3.4H2O
• Formula: C18 H17 K3 O16 V3
• Calculated formula: C18 H9 K3 O16 V3
• Title of publication: A tris-oxovanadium pyrogallate complex: synthesis, structure, and magnetic and electronic properties
• Authors of publication: Mkhadder, Hassan; Denis, Morgane; Giménez-Marqués, Mónica; Cañón-Mancisidor, Walter; Humbert, Bernard; Deunf, Elise; Poizot, Philippe; Devic, Thomas
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 13.734 ± 0.003 Å
• b: 14.379 ± 0.003 Å
• c: 15.837 ± 0.003 Å
• α: 90°
• β: 114.68 ± 0.03°
• γ: 90°
• Cell volume: 2841.8 ± 1.2 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1137
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.1606
• Weighted residual factors for all reflections included in the refinement: 0.1877
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No