Information card for entry 1562133

Structure parameters

• Formula: C24 H14 Cu N4 O8
• Calculated formula: C24 H14 Cu N4 O8
• SMILES: [Cu]12([n]3cc(C(=O)O)ccc3c3[n]1cc(cc3)C(=O)[O-])[n]1cc(C(=O)O)ccc1c1[n]2cc(cc1)C(=O)[O-]
• Title of publication: Syntheses, structures and properties of three metal–organic complexes containing 2,2′-dipyridyl-5,5′-dicarboxylate ligands
• Authors of publication: Liu, Jiancai; Zhang, Yudong; Shang, Sensen; Li, Yanzhou; Chen, Lijuan; Zhao, Junwei
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2015
• Journal volume: 221
• Pages of publication: 5 - 13
• a: 16.4886 ± 0.0015 Å
• b: 23.079 ± 0.002 Å
• c: 13.811 ± 0.002 Å
• α: 90°
• β: 124.366 ± 0.002°
• γ: 90°
• Cell volume: 4338.3 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0653
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.094
• Weighted residual factors for all reflections included in the refinement: 0.1024
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No