Information card for entry 1561212

Structure parameters

• Formula: C36 H44 Cu F4 N8 O12
• Calculated formula: C36 H44 Cu F4 N8 O12
• SMILES: [Cu]1([n]2cn(Cc3cccc(Cn4cncc4)c3)cc2)([n]2cn(cc2)Cc2cccc(c2)Cn2c[n](cc2)[Cu]([OH2])([OH2])[n]2cn(cc2)Cc2cccc(c2)Cn2c[n]1cc2)([OH2])([OH2])[n]1cn(Cc2cccc(Cn3cncc3)c2)cc1.c1(F)c(F)c(C(=O)[O-])c(F)c(F)c1C(=O)[O-].c1(F)c(F)c(C(=O)[O-])c(F)c(F)c1C(=O)[O-].O.O.O.O.O.O.O.O.O.O.O.O
• Title of publication: Cu(II) coordination polymers constructed by tetrafluoroterephthalic acid and varied imidazole-containing ligands: Syntheses, structures and properties
• Authors of publication: Liu, Kang; Sun, Yayong; Deng, Liming; Cao, Fan; Han, Jishu; Wang, Lei
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2018
• Journal volume: 258
• Pages of publication: 24 - 31
• a: 8.6873 ± 0.0008 Å
• b: 11.049 ± 0.0008 Å
• c: 11.3581 ± 0.0007 Å
• α: 91.465 ± 0.005°
• β: 94.945 ± 0.006°
• γ: 108.08 ± 0.007°
• Cell volume: 1030.95 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0873
• Residual factor for significantly intense reflections: 0.0558
• Weighted residual factors for significantly intense reflections: 0.1148
• Weighted residual factors for all reflections included in the refinement: 0.1346
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No