Information card for entry 2215933

Structure parameters

• Chemical name: (2-Amino-4,5-dimethylbenzenesulfonato-κN)aquasilver(I) monohydrate
• Formula: C8 H14 Ag N O5 S
• Calculated formula: C8 H14 Ag N O5 S
• SMILES: [Ag]([NH2]c1c(cc(c(c1)C)C)S(=O)(=O)[O-])[OH2].O
• Title of publication: (2-Amino-4,5-dimethylbenzenesulfonato-κ<i>N</i>)aquasilver(I) monohydrate
• Authors of publication: Li, Yu-Jie; Li, Shi-Hua; Dong, Xian-Wu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2695 - m2695
• a: 6.555 ± 0.005 Å
• b: 7.626 ± 0.006 Å
• c: 12.129 ± 0.0011 Å
• α: 78.889 ± 0.004°
• β: 85.746 ± 0.007°
• γ: 87.754 ± 0.004°
• Cell volume: 593.1 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0327
• Residual factor for significantly intense reflections: 0.0256
• Weighted residual factors for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes