Information card for entry 2020956

Structure parameters

• Chemical name: Lithium chloride dihydrate
• Formula: Cl H4 Li O2
• Calculated formula: Cl H4 Li O2
• SMILES: O.O.[Cl-].[Li+]
• Title of publication: Higher hydrates of lithium chloride, lithium bromide and lithium iodide
• Authors of publication: Sohr, Julia; Schmidt, Horst; Voigt, Wolfgang
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2018
• Journal volume: 74
• Journal issue: 2
• a: 6.0838 ± 0.0008 Å
• b: 9.3592 ± 0.0013 Å
• c: 6.0632 ± 0.0009 Å
• α: 90°
• β: 113.543 ± 0.003°
• γ: 90°
• Cell volume: 316.5 ± 0.08 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• 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: 0.0152
• Residual factor for significantly intense reflections: 0.0147
• Weighted residual factors for significantly intense reflections: 0.0372
• Weighted residual factors for all reflections included in the refinement: 0.0374
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No