Information card for entry 1512955

Structure parameters

• Formula: C25 H32 Cu Gd N5 O14
• Calculated formula: C25 H32 Cu Gd N5 O14
• SMILES: c12c3[O]([Gd]45678(ON(=[O]4)=O)(ON(=[O]5)=O)([O]1[Cu]14[N](=Cc2ccc3)[C@@H]2CCCC[C@H]2[N]1=Cc1c(c(ccc1)[O]7CC)[O]84)ON(=[O]6)=O)CC.OC
• 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: 11.87 ± 0.006 Å
• b: 14.995 ± 0.008 Å
• c: 17.229 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3067 ± 3 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: 0.1467
• Residual factor for significantly intense reflections: 0.1001
• Weighted residual factors for significantly intense reflections: 0.1767
• Weighted residual factors for all reflections included in the refinement: 0.2148
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No