Information card for entry 2236294

Structure parameters

• Chemical name: Tetraamminelithium triamminelithium trisulfide
• Formula: H21 Li2 N7 S3
• Calculated formula: H21 Li2 N7 S3
• SMILES: [Li]([NH3])([NH3])([NH3])[NH3].[Li](SS[S-])([NH3])([NH3])[NH3]
• Title of publication: Tetraamminelithium triamminelithium trisulfide, [Li(NH~3~)~4~][Li(NH~3~)~3~S~3~]
• Authors of publication: Guentner, Christian; Korber, Nikolaus
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 11
• Pages of publication: i84 - i85
• a: 12.422 ± 0.003 Å
• b: 9.3721 ± 0.0019 Å
• c: 22.269 ± 0.005 Å
• α: 90°
• β: 92.46 ± 0.03°
• γ: 90°
• Cell volume: 2590.2 ± 1 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 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: 0.0848
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0705
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 0.812
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes