Information card for entry 4305242

Structure parameters

• Formula: C40 H38 F12 Gd N3 O9 Zn
• Calculated formula: C40 H38 F12 Gd N3 O9 Zn
• SMILES: [Gd]1234(OC(=CC(=[O]4)C(F)(F)F)C(F)(F)F)([O]=C(C(F)(F)F)C=C(O2)C(F)(F)F)([O]2[Zn]5678[O]1c1c(C=[N]8CC(C)(C[N]5=Cc8c2cccc8)C[N]6=Cc2c([O]37)cccc2)cccc1)[OH]CC.OCC
• 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: 12.9143 ± 0.0006 Å
• b: 13.3824 ± 0.0006 Å
• c: 13.4886 ± 0.0003 Å
• α: 86.0347 ± 0.0019°
• β: 77.898 ± 0.002°
• γ: 71.1947 ± 0.0008°
• Cell volume: 2157.67 ± 0.15 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: 0.0367
• Weighted residual factors for all reflections included in the refinement: 0.102
• Goodness-of-fit parameter for all reflections included in the refinement: 0.916
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No