Information card for entry 7714649

Structure parameters

• Chemical name: LiBaAl(BO3)2
• Formula: Al B2 Ba Li O6
• Calculated formula: Al B2 Ba Li O6
• Title of publication: Rb₃MgB₅O₁₀ and LiBaAl(BO₃)₂: covalent tetrahedra MO₄-containing borates with deep-ultraviolet cutoff edges.
• Authors of publication: Su, Hongkang; Jiao, Jiahao; Wang, Shibin; An, Donghai; Zhang, Min
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 932 - 937
• a: 4.9161 ± 0.0001 Å
• b: 8.7222 ± 0.0002 Å
• c: 13.228 ± 0.0003 Å
• α: 90°
• β: 108.29 ± 0.001°
• γ: 90°
• Cell volume: 538.55 ± 0.02 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0116
• Residual factor for significantly intense reflections: 0.0109
• Weighted residual factors for significantly intense reflections: 0.0257
• Weighted residual factors for all reflections included in the refinement: 0.0259
• Goodness-of-fit parameter for all reflections included in the refinement: 1.12
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No