Information card for entry 7107111

Structure parameters

• Formula: Ba2 H4 Ni6 O20 V4
• Calculated formula: Ba2 H4 Ni6 O20 V4
• Title of publication: Frustrated magnetism in the S=1 kagome lattice BaNi3(OH)2(VO4)2
• Authors of publication: Danna E. Freedman; Robin Chisnell; Tyrel M. McQueen; Young S. Lee; Christophe Payen; Daniel G. Nocera
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 64
• a: 10.213 ± 0.006 Å
• b: 5.816 ± 0.003 Å
• c: 7.888 ± 0.004 Å
• α: 90 ± 0.06°
• β: 117.01 ± 0.04°
• γ: 90 ± 0.08°
• Cell volume: 417.4 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.1325
• Residual factor for significantly intense reflections: 0.1306
• Weighted residual factors for significantly intense reflections: 0.3297
• Weighted residual factors for all reflections included in the refinement: 0.3308
• Goodness-of-fit parameter for all reflections included in the refinement: 3.662
• Diffraction radiation wavelength: 1.5406 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No