Information card for entry 1563183

Structure parameters

• Common name: Lithiumborate
• Formula: B3 Li O5
• Calculated formula: B3 Li O5
• Title of publication: High-pressure synthesis and crystal structure of the lithium borate HP-LiB3O5
• Authors of publication: Neumair, Stephanie C.; Vanicek, Stefan; Kaindl, Reinhard; Többens, Daniel M.; Wurst, Klaus; Huppertz, Hubert
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2011
• Journal volume: 184
• Journal issue: 9
• Pages of publication: 2490 - 2497
• a: 8.297 ± 0.0017 Å
• b: 7.596 ± 0.0015 Å
• c: 17.268 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1088.3 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• 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: 0.0358
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No