Information card for entry 7211445

Structure parameters

• Formula: H2 I4 K4 Ni4 O27 V4
• Calculated formula: I4 K3.992 Ni4 O27 V4
• Title of publication: K4TM4(V2O7)2(IO3)4(H2O) (TM = Zn, Ni, Co): a series of quinary mixed metal‒vanadium(v)‒iodates
• Authors of publication: Yang, Bing-Ping; Xu, Xiang; Huang, Chao; Mao, Jiang-Gao
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 48
• Pages of publication: 10464
• a: 5.5379 ± 0.0002 Å
• b: 5.5379 ± 0.0002 Å
• c: 25.931 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 688.72 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 176
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for all reflections: 0.0521
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.0968
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.391
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No