Information card for entry 2014331

Structure parameters

• Common name: glycine sodium thiosulphate dihydrate
• Chemical name: poly[diaqua-μ~3~-glycinato-di-μ~4~-thiosulfato-thiosulfatotetrasodium(I)
• Formula: C2 H9 N Na4 O10 S4
• Calculated formula: C2 H9 N Na4 O10 S4
• SMILES: [Na+].[Na+].[Na+].[Na+].S(=O)([O-])(=S)[O-].S(=O)([O-])(=S)[O-].[O-]C(=O)C[NH3+].O.O
• Title of publication: Compounds of glycine with metal sulfates and thiosulfates: glycine cobalt sulfate pentahydrate, glycine sodium thiosulfate dihydrate and glycine potassium thiosulfate
• Authors of publication: Michel Fleck; Ladislav Bohatý
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 1
• Pages of publication: m22 - m26
• a: 17.775 ± 0.004 Å
• b: 7.311 ± 0.001 Å
• c: 22.595 ± 0.005 Å
• α: 90°
• β: 100.1 ± 0.03°
• γ: 90°
• Cell volume: 2890.8 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.029
• Residual factor for significantly intense reflections: 0.0249
• Weighted residual factors for significantly intense reflections: 0.0625
• Weighted residual factors for all reflections included in the refinement: 0.0649
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No