Information card for entry 2012737

Structure parameters

• Common name: Lithium Barium Diphosphate
• Chemical name: Dilithium barium diphosphate
• Formula: Ba Li2 O7 P2
• Calculated formula: Ba Li2 O7 P2
• SMILES: [Ba+2].[O-]P(=O)([O-])OP(=O)([O-])[O-].[Li+].[Li+]
• Title of publication: Dilithium barium diphosphate
• Authors of publication: Dridi, Nezha; Arbib, E.; Boukhari, Ali; Holt, Elizabeth M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 6
• Pages of publication: i74 - i75
• a: 7.147 ± 0.008 Å
• b: 12.283 ± 0.014 Å
• c: 14.016 ± 0.016 Å
• α: 90°
• β: 90.49 ± 0.07°
• γ: 90°
• Cell volume: 1230 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.071
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.185
• Weighted residual factors for all reflections included in the refinement: 0.189
• Goodness-of-fit parameter for all reflections included in the refinement: 1.489
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes