Information card for entry 2209826

Structure parameters

• Chemical name: Bis[μ-2-(1H-imidazol-2-yl)phenolato]bis[chloromethanolcopper(II)]
• Formula: C20 H22 Cl2 Cu2 N4 O4
• Calculated formula: C20 H22 Cl2 Cu2 N4 O4
• SMILES: c1c[nH]c2c3c(cccc3)[O]3[Cu]([n]12)([OH]C)(Cl)[O]1[Cu]3([n]2cc[nH]c2c2c1cccc2)(Cl)[OH]C
• Title of publication: Bis[μ-2-(1<i>H</i>-imidazol-2-yl)phenolato]bis[chloromethanolcopper(II)]
• Authors of publication: He, Hong-Shan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1782 - m1783
• a: 20.574 ± 0.004 Å
• b: 8.4773 ± 0.0017 Å
• c: 16.859 ± 0.003 Å
• α: 90°
• β: 127.12 ± 0.03°
• γ: 90°
• Cell volume: 2344.6 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1021
• Residual factor for significantly intense reflections: 0.0364
• Weighted residual factors for significantly intense reflections: 0.0653
• Weighted residual factors for all reflections included in the refinement: 0.0841
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes