Information card for entry 2230344

Structure parameters

• Chemical name: Bis[4-amino-<i>N</i>-(pyrimidin-2- yl)benzenesulfonamidato]-κ^2^<i>N</i>,<i>N</i>';κ<i>N</i>- aquabis(dimethylformamide-κ<i>O</i>)cadmium(II) monohydrate
• Formula: C26 H36 Cd N10 O8 S2
• Calculated formula: C26 H36 Cd N10 O8 S2
• SMILES: [Cd]12(N(S(=O)(=O)c3ccc(N)cc3)c3[n]1cccn3)(N(S(=O)(=O)c1ccc(N)cc1)c1[n]2cccn1)([O]=CN(C)C)([O]=CN(C)C)[OH2].O
• Title of publication: Bis[4-amino-<i>N</i>-(pyrimidin-2-yl)benzenesulfonamidato]-κ^2^<i>N</i>,<i>N</i>';κ<i>N</i>-aquabis(dimethylformamide-κ<i>O</i>)cadmium(II) monohydrate
• Authors of publication: Hossain, G. M. Golzar
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 6
• Pages of publication: m805 - m806
• a: 13.9012 ± 0.0003 Å
• b: 9.9763 ± 0.0002 Å
• c: 23.8147 ± 0.0005 Å
• α: 90°
• β: 103.203 ± 0.001°
• γ: 90°
• Cell volume: 3215.38 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0611
• Residual factor for significantly intense reflections: 0.0417
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.0988
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes