Information card for entry 2226027

Structure parameters

• Chemical name: (2-{[2-Carboxylato-1-(4-chlorophenyl)ethyl]iminomethyl}phenolato- κ^3^<i>O</i>,<i>N</i>,<i>O</i>')(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II) monohydrate
• Formula: C19 H18 Cl Cu N3 O4
• Calculated formula: C19 H18 Cl Cu N3 O4
• Title of publication: (2-{[2-Carboxylato-1-(4-chlorophenyl)ethyl]iminomethyl}phenolato-κ^3^<i>O</i>,<i>N</i>,<i>O</i>')(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II) monohydrate
• Authors of publication: Zhou, Wen-Jun; Jiang, Yin-Zhi; Zou, Yang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: m579 - m580
• a: 23.884 ± 0.001 Å
• b: 4.944 ± 0.001 Å
• c: 32.008 ± 0.001 Å
• α: 90°
• β: 96.88 ± 0.01°
• γ: 90°
• Cell volume: 3752.4 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.0522
• Residual factor for significantly intense reflections: 0.0352
• Weighted residual factors for significantly intense reflections: 0.08
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes