Information card for entry 7055643

Structure parameters

• Chemical name: dichlorido-bis[N-(4-methoxyphenyl)acetamide-O]-zinc(II)
• Formula: C18 H22 Cl2 N2 O4 Zn
• Calculated formula: C18 H22 Cl2 N2 O4 Zn
• SMILES: CC(=[O][Zn](Cl)([O]=C(C)Nc1ccc(cc1)OC)Cl)Nc1ccc(cc1)OC
• Title of publication: Exploiting the potential of aryl acetamide derived Zn(ii) complexes in medicinal chemistry: synthesis, structural analysis, assessment of biological profile and molecular docking studies
• Authors of publication: Sultana, Kishwar; Zaib, Sumera; Hassan Khan, Najm ul; Khan, Imtiaz; Shahid, Khadija; Simpson, Jim; Iqbal, Jamshed
• Journal of publication: New J. Chem.
• Year of publication: 2016
• Journal volume: 40
• Journal issue: 8
• Pages of publication: 7084
• a: 16.8955 ± 0.0006 Å
• b: 10.3515 ± 0.0004 Å
• c: 11.5475 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2019.59 ± 0.14 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Residual factor for all reflections: 0.0257
• Residual factor for significantly intense reflections: 0.0256
• Weighted residual factors for significantly intense reflections: 0.0664
• Weighted residual factors for all reflections included in the refinement: 0.0665
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No