Information card for entry 1574468

Structure parameters

• Formula: C50 H52 Dy N5 O11 P2 Se2
• Calculated formula: C50 H52 Dy N5 O11 P2 Se2
• Title of publication: A thermally and photoresponsive luminescent single-molecule magnet based on dysprosium–anthracene: effect of temperature on anthracene photocycloaddition
• Authors of publication: Ma, Xiu-Fang; Hou, Xin-Lan; Qin, Ye-Hui; Teng, Qian; Bao, Song-Song; Tian, Yu-Xi; Zheng, Li-Min
• Journal of publication: Chemical Science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 23
• Pages of publication: 10340 - 10348
• a: 9.5847 ± 0.0012 Å
• b: 25.809 ± 0.003 Å
• c: 11.2751 ± 0.0013 Å
• α: 90°
• β: 112.946 ± 0.003°
• γ: 90°
• Cell volume: 2568.4 ± 0.5 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 300 ± 2 K
• Number of distinct elements: 7
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.1493
• Residual factor for significantly intense reflections: 0.0858
• Weighted residual factors for significantly intense reflections: 0.1817
• Weighted residual factors for all reflections included in the refinement: 0.2206
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No