Information card for entry 7020738

Structure parameters

• Formula: C28 H24 Cu2 N4 O10
• Calculated formula: C28 H24 Cu2 N4 O10
• SMILES: c12c3[n]([Cu]456([n]1cccc2)[O](C(=O)C[O]4CC(=O)O5)[Cu]124([n]5c(c7cccc[n]17)cccc5)[O]6C(=O)C[O]2CC(=O)O4)cccc3
• Title of publication: Syntheses, structures and chemical sensing properties of three complexes with mixed ligands of carboxylate and bipyridine.
• Authors of publication: Jiao, Chengli; Li, Fen; Zhang, Jian; Li, Zhangpeng; Wang, Shuang; Wang, Zhonggang; Yu, Hao; Li, Zhibao; Liu, Shuang; Wang, Ziqiang; Jiang, Xia; Sun, Lixian; Xu, Fen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 5
• Pages of publication: 1346 - 1351
• a: 9.731 ± 0.005 Å
• b: 13.576 ± 0.007 Å
• c: 10.412 ± 0.006 Å
• α: 90°
• β: 94.825 ± 0.007°
• γ: 90°
• Cell volume: 1370.6 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0504
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0713
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No