Information card for entry 2235277

Structure parameters

• Chemical name: Dichloridobis[ethyl 2-(2-amino-1,3-thiazol-4-yl)acetate-κ^2^<i>O</i>,<i>N</i>^3^]cadmium
• Formula: C14 H20 Cd Cl2 N4 O4 S2
• Calculated formula: C14 H20 Cd Cl2 N4 O4 S2
• SMILES: [Cd]12(Cl)(Cl)([O]=C(OCC)Cc3[n]1c(sc3)N)[O]=C(OCC)Cc1[n]2c(sc1)N
• Title of publication: Dichloridobis[ethyl 2-(2-amino-1,3-thiazol-4-yl)acetate-κ^2^<i>O</i>,<i>N</i>^3^]cadmium
• Authors of publication: Zhang, Lai-Jun; Chen, Fa-Yun; Liu, Guang-Yi; Chen, Xiao; Chen, Zhi-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 6
• Pages of publication: m788 - m789
• a: 16.86 ± 0.003 Å
• b: 16.63 ± 0.003 Å
• c: 16.22 ± 0.003 Å
• α: 90°
• β: 105.41 ± 0.03°
• γ: 90°
• Cell volume: 4384.3 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0239
• Residual factor for significantly intense reflections: 0.0215
• Weighted residual factors for significantly intense reflections: 0.0473
• Weighted residual factors for all reflections included in the refinement: 0.0483
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes