Information card for entry 4347290

Structure parameters

• Formula: C45 H32 Dy F9 N2 O6
• Calculated formula: C45 H32 Dy F9 N2 O6
• SMILES: [Dy]1234([O]=C(C=C(O3)C(F)(F)F)c3ccc(cc3)C)([O]=C(C=C(O1)c1ccc(C)cc1)C(F)(F)F)([O]=C(c1ccc(cc1)C)C=C(O2)C(F)(F)F)[n]1c2c3[n]4cccc3ccc2ccc1
• Title of publication: Magnetization Dynamics Changes of Dysprosium(III) Single-Ion Magnets Associated with Guest Molecules.
• Authors of publication: Zhang, Sheng; Ke, Hongshan; Sun, Lin; Li, Xin; Shi, Quan; Xie, Gang; Wei, Qing; Yang, Desuo; Wang, Wenyuan; Chen, Sanping
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 8
• Pages of publication: 3865 - 3871
• a: 10.5725 ± 0.0017 Å
• b: 12.565 ± 0.002 Å
• c: 18.395 ± 0.003 Å
• α: 85.084 ± 0.003°
• β: 75.023 ± 0.003°
• γ: 65.326 ± 0.003°
• Cell volume: 2144.4 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1261
• Residual factor for significantly intense reflections: 0.0992
• Weighted residual factors for significantly intense reflections: 0.2218
• Weighted residual factors for all reflections included in the refinement: 0.2521
• Goodness-of-fit parameter for all reflections included in the refinement: 1.284
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No