Information card for entry 8105521

Structure parameters

• Formula: C16 H12 Cl2 Cu N2 O2
• Calculated formula: C16 H12 Cl2 Cu N2 O2
• Title of publication: Crystal structure of (6,6′-((ethane-1,2-diylbis(azanylylidene))bis(methanylylidene))bis(2-chlorophenolato-κ2 N,O))copper(II), C16H12Cl2CuN2O2
• Authors of publication: Ju, Hongping; Li, Meihua; Chen, Zihao; Wu, Qiong; Chai, Yanling
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 234
• Journal issue: 1
• Pages of publication: 3 - 4
• a: 12.8449 ± 0.0005 Å
• b: 12.5266 ± 0.0006 Å
• c: 19.054 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3065.8 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0633
• Residual factor for significantly intense reflections: 0.0423
• Weighted residual factors for significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.1164
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No