Information card for entry 7705948

Structure parameters

• Formula: C38 H44 Dy2 N6 O16
• Calculated formula: C38 H44 Dy2 N6 O16
• SMILES: [Dy]12345([O]6[Dy]789([O]1c1c(C[N]8=Cc8c(O7)ccc(OC)c8)cccc1[O]3C)([O]=CN(C)C)([O](c1c6c(C[N]4=Cc3c(O2)ccc(OC)c3)ccc1)C)ON(=[O]9)=O)([O]=CN(C)C)ON(=[O]5)=O
• Title of publication: Evolution from a single relaxation process to two-step relaxation processes of Dy₂ single-molecule magnets via the modulations of the terminal solvent ligands.
• Authors of publication: Li, Dawei; Ding, Man-Man; Huang, Yuan; Tello Yepes, David Felipe; Li, Haiyan; Li, Yahong; Zhang, Yi-Quan; Yao, Jinlei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 1
• Pages of publication: 217 - 228
• a: 16.072 ± 0.0014 Å
• b: 16.4037 ± 0.0014 Å
• c: 18.1256 ± 0.0016 Å
• α: 90°
• β: 100.123 ± 0.002°
• γ: 90°
• Cell volume: 4704.2 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 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: 0.1044
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.1095
• Weighted residual factors for all reflections included in the refinement: 0.1324
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No