Information card for entry 1564292

Structure parameters

• Formula: C15 H7 Dy F18 O8
• Calculated formula: C15 H7 Dy F18 O8
• SMILES: C(C1=CC(C(F)(F)F)=[O][Dy]23(O1)([O]=C(C(F)(F)F)C=C(C(F)(F)F)O2)(OC(=CC(C(F)(F)F)=[O]3)C(F)(F)F)([OH2])[OH2])(F)(F)F
• Title of publication: Observation of field-induced single-ion magnet behavior in a mononuclear DyIII complex by co-crystallization of a square-planar CuII complex
• Authors of publication: Li, Xi-Li; Li, Junfeng; Wang, Ailing; Liu, Cai-Ming; Cui, Minghui; Zhang, Yi-Quan
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2020
• Journal volume: 510
• Pages of publication: 119718
• a: 21.401 ± 0.0016 Å
• b: 19.267 ± 0.002 Å
• c: 16.0855 ± 0.0012 Å
• α: 90°
• β: 91.054 ± 0.003°
• γ: 90°
• Cell volume: 6631.5 ± 1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0544
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.0984
• Weighted residual factors for all reflections included in the refinement: 0.0999
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No