Information card for entry 2239925

Structure parameters

• Chemical name: Bis(acetato-κ<i>O</i>)bis(pyridine-2-carboxamide oxime-κ^2^<i>N</i>,<i>N</i>')cadmium ethanol disolvate
• Formula: C20 H32 Cd N6 O8
• Calculated formula: C20 H32 Cd N6 O8
• SMILES: c1cccc2C(N)=[N](O)[Cd]3([n]12)(OC(=O)C)([n]1ccccc1C(N)=[N]3O)OC(=O)C.C(O)C.C(O)C
• Title of publication: Crystal structure of bis(acetato-κ<i>O</i>)bis(pyridine-2-carboxamide oxime-κ^2^<i>N</i>,<i>N</i>')cadmium ethanol disolvate
• Authors of publication: Liu, Jiyong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 9
• Pages of publication: 142 - 144
• a: 15.894 ± 0.003 Å
• b: 10.9654 ± 0.0017 Å
• c: 15.0212 ± 0.0016 Å
• α: 90°
• β: 91.746 ± 0.012°
• γ: 90°
• Cell volume: 2616.7 ± 0.7 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• 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: 0.0602
• Residual factor for significantly intense reflections: 0.0469
• Weighted residual factors for significantly intense reflections: 0.1125
• Weighted residual factors for all reflections included in the refinement: 0.1251
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes