Information card for entry 4341822

Structure parameters

• Formula: B2 F Li6 O6 Rb
• Calculated formula: B2 F Li6 O6 Rb
• SMILES: B([O-])([O-])[O-].[F-].[Li+].[Li+].[Li+].[Rb+].B([O-])([O-])[O-].[Li+].[Li+].[Li+]
• Title of publication: Borate Fluoride and Fluoroborate in Alkali-Metal Borate Prepared by an Open High-Temperature Solution Method.
• Authors of publication: Wu, Hongping; Yu, Hongwei; Bian, Qiang; Yang, Zhihua; Han, Shujuan; Pan, Shilie
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Pages of publication: 141201120741005
• a: 8.414 ± 0.013 Å
• b: 15.96 ± 0.02 Å
• c: 5.081 ± 0.008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 682.3 ± 1.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0811
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1061
• Weighted residual factors for all reflections included in the refinement: 0.1243
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No