Information card for entry 2204255

Structure parameters

• Chemical name: Dichloro[3,3'-bis(ethoxycarbonyl)-2,2'-bipyridyl-κ^2^N,N']copper(II)
• Formula: C16 H16 Cl2 Cu N2 O4
• Calculated formula: C16 H16 Cl2 Cu N2 O4
• SMILES: c1ccc(c2[n]1[Cu]([n]1cccc(c21)C(=O)OCC)(Cl)Cl)C(=O)OCC
• Title of publication: Dichloro[3,3'-bis(ethoxycarbonyl)-2,2'-bipyridyl-κ^2^<i>N,N</i>']copper(II)
• Authors of publication: Wu, Ben-Lai; Zhou, You-Fu; Han, Lei; Hong, Mao-Chun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 10
• Pages of publication: m1365 - m1366
• a: 11.3605 ± 0.0016 Å
• b: 11.2772 ± 0.0015 Å
• c: 13.5039 ± 0.0019 Å
• α: 90°
• β: 91.269 ± 0.003°
• γ: 90°
• Cell volume: 1729.6 ± 0.4 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: 0.0919
• Residual factor for significantly intense reflections: 0.0683
• Weighted residual factors for significantly intense reflections: 0.1266
• Weighted residual factors for all reflections included in the refinement: 0.1379
• Goodness-of-fit parameter for all reflections included in the refinement: 1.234
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes