Information card for entry 2213916

Structure parameters

• Chemical name: (2-Amino-4,5-dimethylbenzenesulfonato-κ<i>N</i>)diaquasilver(I)
• Formula: C8 H14 Ag N O5 S
• Calculated formula: C8 H14 Ag N O5 S
• SMILES: c1(cc(c(cc1[NH2][Ag]([OH2])[OH2])C)C)S(=O)(=O)[O-]
• Title of publication: (2-Amino-4,5-dimethylbenzenesulfonato-κ<i>N</i>)diaquasilver(I)
• Authors of publication: Jia-Jun Han; Ning Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 6
• Pages of publication: m1635 - m1635
• a: 12.0636 ± 0.0006 Å
• b: 9.8642 ± 0.0005 Å
• c: 10.3509 ± 0.0006 Å
• α: 90°
• β: 93.263 ± 0.001°
• γ: 90°
• Cell volume: 1229.74 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0409
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0954
• Weighted residual factors for all reflections included in the refinement: 0.0971
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes