Information card for entry 4303198

Structure parameters

• Formula: C27 H18 Br F18 N3 O8 Tm
• Calculated formula: C27 H18 Br F18 N3 O8 Tm
• Title of publication: Four New Lanthanide-Nitronyl Nitroxide (LnIII= PrIII, SmIII, EuIII, TmIII) Complexes and a TbIII Complex Exhibiting Single-Molecule Magnet Behavior
• Authors of publication: Jin-Xia Xu; Yue Ma; Dai-zheng Liao; Gong-Feng Xu; Jinkui Tang; Chao Wang; Na Zhou; Shi-Ping Yan; Peng Cheng; Li-Cun Li
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 8890 - 8896
• a: 13.045 ± 0.003 Å
• b: 18.283 ± 0.004 Å
• c: 15.819 ± 0.003 Å
• α: 90°
• β: 94.53 ± 0.03°
• γ: 90°
• Cell volume: 3761.1 ± 1.4 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0439
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.0948
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No