Information card for entry 2013234

Structure parameters

• Formula: C12 H12 Cl4 Cu N2
• Calculated formula: C12 H12 Cl4 Cu N2
• SMILES: [n]1(cc(ccc1Cl)C)[Cu](Cl)([n]1c(ccc(c1)C)Cl)Cl
• Title of publication: Dichlorobis(2-chloro-5-methylpyridine-κ<i>N</i>)copper(II)
• Authors of publication: Richeng Xuan; Weixiao Hu; Zhongyu Yang; Rirong Xuan
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 4
• Pages of publication: m112 - m114
• a: 5.862 ± 0.001 Å
• b: 12.941 ± 0.004 Å
• c: 10.538 ± 0.004 Å
• α: 90°
• β: 105.12 ± 0.03°
• γ: 90°
• Cell volume: 771.7 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for all reflections included in the refinement: 0.1164
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No