Information card for entry 4349108

Structure parameters

• Formula: C8 H16 Dy N3 O13
• Calculated formula: C8 H16 Dy N3 O13
• SMILES: [Dy]123456(ON(=[O]1)=O)([O]=N(=O)O2)(ON(=[O]4)=O)[O]1CC[O]3CC[O]5CC[O]6CC1
• Title of publication: Syntheses, structures and magnetic properties of a series of mono- and di-nuclear dysprosium(iii)-crown-ether complexes: effects of a weak ligand-field and flexible cyclic coordination modes
• Authors of publication: Ding, You-Song; Han, Tian; Hu, Yue-Qiao; Xu, Minwei; Yang, Sen; Zheng, Yan-Zhen
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2016
• Journal volume: 3
• Journal issue: 6
• Pages of publication: 798
• a: 12.0689 ± 0.0017 Å
• b: 8.5236 ± 0.0013 Å
• c: 15.178 ± 0.002 Å
• α: 90°
• β: 91.235 ± 0.007°
• γ: 90°
• Cell volume: 1561 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.1267
• Residual factor for significantly intense reflections: 0.1256
• Weighted residual factors for significantly intense reflections: 0.3125
• Weighted residual factors for all reflections included in the refinement: 0.3131
• Goodness-of-fit parameter for all reflections included in the refinement: 1.172
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No