Information card for entry 4349862

Structure parameters

• Formula: C80 H70 Cl4 Dy2 O14
• Calculated formula: C80 H70 Cl4 Dy2 O14
• SMILES: c12cccc3c2[O]2[Dy]456([O]1C)(OC(=CC(=[O]4)c1ccccc1)c1ccccc1)(OC(=CC(=[O]6)c1ccccc1)c1ccccc1)[O]1c4c(cccc4[O](C)[Dy]4621([O]3C)(OC(=CC(=[O]4)c1ccccc1)c1ccccc1)[O]=C(c1ccccc1)C=C(O6)c1ccccc1)[O]5C.C(CCl)Cl.C(CCl)Cl
• Title of publication: Dramatic impact of the lattice solvent on the dynamic magnetic relaxation of dinuclear dysprosium single-molecule magnets
• Authors of publication: Zhang, Wan-Ying; Zhang, Yi-Quan; Jiang, Shang-Da; Sun, Wen-Bin; Li, Hong-Feng; Wang, Bing-Wu; Chen, Peng; Yan, Peng-Fei; Gao, Song
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2018
• Journal volume: 5
• Journal issue: 7
• Pages of publication: 1575
• a: 11.4039 ± 0.0003 Å
• b: 13.0199 ± 0.0005 Å
• c: 13.9897 ± 0.0005 Å
• α: 70.393 ± 0.003°
• β: 71.631 ± 0.003°
• γ: 75.913 ± 0.003°
• Cell volume: 1834.87 ± 0.12 ų
• Cell temperature: 180.01 ± 0.1 K
• Ambient diffraction temperature: 180.01 ± 0.1 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: 0.0496
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0569
• Weighted residual factors for all reflections included in the refinement: 0.0649
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No