Information card for entry 2214803

Structure parameters

• Chemical name: Dipotassium hexafluoridozirconate(IV) hydrogen fluoride
• Formula: F14 H2 K4 Zr2
• Calculated formula: F14 H2 K4 Zr2
• SMILES: [Zr]1(F)(F)(F)(F)(F)[F][Zr](F)(F)(F)(F)(F)[F]1.[K+].[K+].[K+].[K+].F.F
• Title of publication: Dipotassium hexafluoridozirconate(IV) hydrogen fluoride, K~2~ZrF~6~·HF
• Authors of publication: Gerasimenko, A. V.; Didenko, N. A.; Kavun, V. Ya.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 8
• Pages of publication: i171 - i171
• a: 13.3641 ± 0.0005 Å
• b: 11.4457 ± 0.0004 Å
• c: 8.5211 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1303.4 ± 0.08 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0342
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0699
• Weighted residual factors for all reflections included in the refinement: 0.0712
• Goodness-of-fit parameter for all reflections included in the refinement: 1.21
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes