Information card for entry 7709121

Structure parameters

• Formula: C34 H26 Dy N7 O16
• Calculated formula: C34 H26 Dy N7 O16
• SMILES: [Dy]123(Oc4c(c5c(cc4)cccc5)/C=[NH+]/c4ccc(N(=O)=O)cc4)(Oc4c(c5c(cc4)cccc5)/C=[NH+]/c4ccc(N(=O)=O)cc4)(ON(=[O]1)=O)(ON(=[O]2)=O)(ON(=O)=[O]3)[OH2]
• Title of publication: Four mononuclear dysprosium complexes with neutral Schiff-base ligands: syntheses, crystal structures and slow magnetic relaxation behavior
• Authors of publication: Yang, Hui; Liu, Shan-Shan; Meng, Yin-Shan; Zhang, Yi-Quan; Pu, Lin; Wang, Xincheng; Lin, Shijing
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 7.6525 ± 0.0003 Å
• b: 13.5408 ± 0.0006 Å
• c: 17.703 ± 0.0006 Å
• α: 74.093 ± 0.003°
• β: 88.444 ± 0.003°
• γ: 87.655 ± 0.003°
• Cell volume: 1762.44 ± 0.12 ų
• Cell temperature: 296 ± 1 K
• Ambient diffraction temperature: 296 ± 1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0628
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1481
• Weighted residual factors for all reflections included in the refinement: 0.1534
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No