Information card for entry 2300631

Structure parameters

• Chemical name: Lithium borohydride
• Formula: B H4 Li
• Calculated formula: B H4 Li
• SMILES: [BH4-].[Li+]
• Title of publication: μCHILL: a lightweight, modular system for handling crystalline samples at low temperatures under inert conditions
• Authors of publication: Solar, Michael; Trapp, Nils
• Journal of publication: Journal of Applied Crystallography
• Year of publication: 2018
• Journal volume: 51
• Journal issue: 2
• a: 7.1374 ± 0.0007 Å
• b: 4.4172 ± 0.0005 Å
• c: 6.7029 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 211.32 ± 0.04 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0581
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.1358
• Weighted residual factors for all reflections included in the refinement: 0.1381
• Goodness-of-fit parameter for all reflections included in the refinement: 1.155
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes