Information card for entry 2237973

Structure parameters

• Common name: Li3[AsS4].8H2O
• Chemical name: Trilithium thioarsenate octahydrate
• Formula: As H16 Li3 O8 S4
• Calculated formula: As H16 Li3 O8 S4
• SMILES: O.O.O.O.O.O.O.O.S=[As]([S-])([S-])[S-].[Li+].[Li+].[Li+]
• Title of publication: Trilithium thioarsenate octahydrate
• Authors of publication: Mereiter, Kurt
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 5
• Pages of publication: i30 - i31
• a: 10.036 ± 0.002 Å
• b: 10.064 ± 0.002 Å
• c: 14.264 ± 0.003 Å
• α: 90°
• β: 107.3 ± 0.01°
• γ: 90°
• Cell volume: 1375.5 ± 0.5 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0485
• Residual factor for significantly intense reflections: 0.0278
• Weighted residual factors for significantly intense reflections: 0.0515
• Weighted residual factors for all reflections included in the refinement: 0.0573
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes