Information card for entry 4305241

Structure parameters

• Formula: C40 H40 Dy F12 N3 Ni O10
• Calculated formula: C40 H40 Dy F12 N3 Ni O10
• SMILES: [Dy]1234(OC(=CC(=[O]2)C(F)(F)F)C(F)(F)F)([O]2[Ni]5678[O]1c1c(C=[N]7CC(C)(C[N]8=Cc7c2cccc7)C[N]5=Cc2c([O]36)cccc2)cccc1)([O]=C(C(F)(F)F)C=C(O4)C(F)(F)F)[OH]CC.OCC.O
• Title of publication: Synthesis, Structures, and Magnetic Properties of Face-Sharing Heterodinuclear Ni(II)-Ln(III) (Ln = Eu, Gd, Tb, Dy) Complexes
• Authors of publication: Tomoka Yamaguchi; Yukinari Sunatsuki; Hiroyuki Ishida; Masaaki Kojima; Haruo Akashi; Nazzareno Re; Naohide Matsumoto; Andrzej Pochaba; Jerzy Mroziński
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 5736 - 5745
• a: 12.814 ± 0.004 Å
• b: 13.404 ± 0.005 Å
• c: 14.868 ± 0.005 Å
• α: 83.612 ± 0.014°
• β: 64.495 ± 0.012°
• γ: 87.906 ± 0.012°
• Cell volume: 2290.4 ± 1.4 ų
• Cell temperature: 93.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for all reflections included in the refinement: 0.1294
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No