Information card for entry 2215932

Structure parameters

• Chemical name: catena-Poly[[bis(1-ethyl-1H-imidazole)copper(II)]-μ-benzene-1,3-dicarboxylato]
• Formula: C18 H20 Cu N4 O4
• Calculated formula: C18 H20 Cu N4 O4
• SMILES: [Cu]([n]1cn(CC)cc1)([n]1cn(CC)cc1)OC(=O)c1cc(ccc1)C(=O)O[Cu]([n]1cn(CC)cc1)([n]1cn(CC)cc1)OC(=O)c1cc(ccc1)C(=O)[O-]
• Title of publication: <i>catena</i>-Poly[[bis(1-ethyl-1<i>H</i>-imidazole)copper(II)]-μ-benzene-1,3-dicarboxylato]
• Authors of publication: Jun Hong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2671 - m2671
• a: 15.817 ± 0.003 Å
• b: 7.2249 ± 0.0014 Å
• c: 17.509 ± 0.004 Å
• α: 90°
• β: 108.29 ± 0.03°
• γ: 90°
• Cell volume: 1899.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0434
• Residual factor for significantly intense reflections: 0.0346
• Weighted residual factors for significantly intense reflections: 0.1059
• Weighted residual factors for all reflections included in the refinement: 0.1116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.15
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes