Information card for entry 2213633

Structure parameters

• Chemical name: Dichloridobis[3-(1H-imidazol-1-yl)-1-phenylpropan-1-one-κN^3^]cadmium(II)
• Formula: C24 H24 Cd Cl2 N4 O2
• Calculated formula: C24 H24 Cd Cl2 N4 O2
• SMILES: [Cd](Cl)(Cl)([n]1cn(cc1)CCC(=O)c1ccccc1)[n]1cn(cc1)CCC(=O)c1ccccc1
• Title of publication: Dichloridobis[3-(1<i>H</i>-imidazol-1-yl)-1-phenylpropan-1-one-κ<i>N</i>^3^]cadmium(II)
• Authors of publication: Guo, Jian-Hua; Cai, Hua
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: m1322 - m1324
• a: 9.2603 ± 0.0013 Å
• b: 9.2321 ± 0.0013 Å
• c: 28.902 ± 0.004 Å
• α: 90°
• β: 96.798 ± 0.002°
• γ: 90°
• Cell volume: 2453.5 ± 0.6 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: 0.0382
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0532
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes