Information card for entry 4349005

Structure parameters

• Formula: C52 H36 Br2 F12 N4 O10 Y2
• Calculated formula: C52 H30 Br2 F12 N4 O10 Y2
• Title of publication: Modulating single-molecule magnet behaviour of phenoxo-O bridged lanthanide(iii) dinuclear complexes by using different β-diketonate coligands
• Authors of publication: Wang, Wen-Min; Wang, Shi-Yu; Zhang, Hong-Xia; Shen, Hai-Yun; Zou, Ji-Yong; Gao, Hong-Ling; Cui, Jian-Zhong; Zhao, Bin
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2016
• Journal volume: 3
• Journal issue: 1
• Pages of publication: 133
• a: 16.759 ± 0.003 Å
• b: 16.602 ± 0.003 Å
• c: 19.907 ± 0.004 Å
• α: 90°
• β: 99.08 ± 0.03°
• γ: 90°
• Cell volume: 5469.4 ± 1.8 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 7
• 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: 0.0907
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for significantly intense reflections: 0.1435
• Weighted residual factors for all reflections included in the refinement: 0.161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No