Information card for entry 1512954

Structure parameters

• Formula: C25 H32 Cu Gd N5 O14
• Calculated formula: C25 H32 Cu Gd N5 O14
• SMILES: CC[O]1c2c3c(C=[N]4[C@H]5CCCC[C@@H]5[N]5=Cc6cccc7c6[O]6[Cu]45[O]3[Gd]34516([O]7CC)(ON(=[O]3)=O)([O]=N(=O)O4)[O]=N(=O)O5)ccc2.CO
• Title of publication: One-dimensional zigzag chain of Cu-Gd coordination polymers derived from chiral hexadentate Schiff base ligands: Synthesis, structure and magnetic properties
• Authors of publication: Yan Sui; Dong-Sheng Liu; Rong-Hua Hu; Jian-Gen Huang
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2013
• Journal volume: 395
• Pages of publication: 225 - 229
• a: 11.8 ± 0.004 Å
• b: 14.935 ± 0.005 Å
• c: 17.186 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3028.7 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0609
• Residual factor for significantly intense reflections: 0.0593
• Weighted residual factors for significantly intense reflections: 0.1521
• Weighted residual factors for all reflections included in the refinement: 0.153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No