Information card for entry 1543312

Structure parameters

• Formula: C47 H40 Dy N12 O7 Rb
• Calculated formula: C47 H40 Dy N12 O7 Rb
• Title of publication: Thermostability and photoluminescence of Dy(iii) single-molecule magnets under a magnetic field
• Authors of publication: Bi, Ye; Chen, Cheng; Zhao, Yi-Fang; Zhang, Yi-Quan; Jiang, Shang-Da; Wang, Bing-Wu; Han, Jun-Bo; Sun, Jun-Liang; Bian, Zu-Qiang; Wang, Zhe-Ming; Gao, Song
• Journal of publication: Chem. Sci.
• Year of publication: 2016
• Journal volume: 7
• Journal issue: 8
• Pages of publication: 5020
• a: 12.1604 ± 0.0004 Å
• b: 14.3443 ± 0.0005 Å
• c: 14.978 ± 0.0004 Å
• α: 83.549 ± 0.003°
• β: 68.8 ± 0.003°
• γ: 83.086 ± 0.003°
• Cell volume: 2411.43 ± 0.14 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.1016
• 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