Information card for entry 2019825

Structure parameters

• Chemical name: Bis[μ-methoxy(pyridin-2-yl)methanolato-κ^3^<i>N</i>,<i>O</i>:<i>O</i>]bis[chloridocopper(II)]
• Formula: C14 H16 Cl2 Cu2 N2 O4
• Calculated formula: C14 H16 Cl2 Cu2 N2 O4
• SMILES: c1cccc2C(=[O]3[Cu]([n]12)([O]1=C(c2cccc[n]2[Cu]31Cl)OC)Cl)OC
• Title of publication: Crystal structure of bis[μ-methoxy(pyridin-2-yl)methanolato-κ3N,O:O]bis[chloridocopper(II)]
• Authors of publication: Boonlue, Sujirat; Sirikulkajorn, Anchalee; Chainok, Kittipong
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 2
• Pages of publication: m44
• a: 10.5568 ± 0.0014 Å
• b: 4.0728 ± 0.0006 Å
• c: 19.257 ± 0.003 Å
• α: 90°
• β: 95.28 ± 0.003°
• γ: 90°
• Cell volume: 824.5 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0838
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.0962
• Weighted residual factors for all reflections included in the refinement: 0.1076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes