Information card for entry 1543957

Structure parameters

• Formula: C20 H18 Cl2 N6 Ni O2
• Calculated formula: C20 H18 Cl2 N6 Ni O2
• SMILES: [Ni]12(Cl)(Cl)([n]3c(c[nH]c3)C=[N]1c1ccccc1O)[n]1c[nH]cc1C=[N]2c1ccccc1O
• Title of publication: Two novel analogous Ni(II) and Cd(II) complexes of an imidazole based Schiff base obtained from imidazole-4-carbaldehyde and 2-aminophenol
• Authors of publication: Serkan Demir; Turan K. Yazicilar; Murat Tas
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2014
• Pages of publication: 398 - 406
• a: 7.9712 ± 0.0005 Å
• b: 12.9977 ± 0.001 Å
• c: 10.537 ± 0.0007 Å
• α: 90°
• β: 96.647 ± 0.006°
• γ: 90°
• Cell volume: 1084.37 ± 0.13 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0557
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0918
• Weighted residual factors for all reflections included in the refinement: 0.1048
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No