Information card for entry 4348609

Structure parameters

• Formula: C156 H106 F6 N12 O16 Tb4
• Calculated formula: C156 H106 F6 N12 O16 Tb4
• SMILES: [n]12cccc3c(/N=C/c4ccc(F)cc4)ccc([O]4[Tb]56781([n]1cccc9c(/N=C/c%10ccc(F)cc%10)ccc([O]6[Tb]6%10%11%124([n]4cccc%13c(/N=C/c%14ccc(cc%14)F)ccc([O]%11[Tb]%11%14%15%16%17([n]%18cccc%19c(/N=C/c%20ccc(F)cc%20)ccc([O]%15[Tb]%15%20([OH]76)([n]6cccc7c(/N=C/c%21ccc(F)cc%21)ccc([O]8%20)c67)(OC(=CC(c6ccccc6)=[O]%15)c6ccccc6)([O]%16c6ccc(/N=C/c7ccc(F)cc7)c7ccc[n]%11c67)[OH]%12%17)c%18%19)OC(=CC(=[O]%14)c6ccccc6)c6ccccc6)c4%13)OC(=CC(c4ccccc4)=[O]%10)c4ccccc4)c19)OC(=CC(=[O]5)c1ccccc1)c1ccccc1)c23
• Title of publication: Single-Molecule-Magnet Behavior and Fluorescence Properties of 8-Hydroxyquinolinate Derivative-Based Rare-Earth Complexes.
• Authors of publication: Gao, Hong-Ling; Jiang, Li; Wang, Wen-Min; Wang, Shi-Yu; Zhang, Hong-Xia; Cui, Jian-Zhong
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 17
• Pages of publication: 8898 - 8904
• a: 18.399 ± 0.004 Å
• b: 18.622 ± 0.004 Å
• c: 22.385 ± 0.005 Å
• α: 90°
• β: 108.83 ± 0.03°
• γ: 90°
• Cell volume: 7259 ± 3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0623
• Residual factor for significantly intense reflections: 0.0478
• Weighted residual factors for significantly intense reflections: 0.1043
• Weighted residual factors for all reflections included in the refinement: 0.1118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No