Information card for entry 7060155

Structure parameters

• Formula: C36 H42 Dy2 N4 O16
• Calculated formula: C36 H42 Dy2 N4 O16
• Title of publication: Assembling two Dy2 single-molecule magnets with different energy barriers via fine-tuning the geometries of DyIII sites
• Authors of publication: Li, Dawei; Ding, Man-Man; Ge, Yu; Tello Yepes, David Felipe; Sun, Mingyuan; Najib, Muhammad Saleem; Li, Yahong; Zhang, Yi-Quan; Yao, Jin-lei
• Journal of publication: New Journal of Chemistry
• Year of publication: 2020
• Journal volume: 44
• Journal issue: 47
• Pages of publication: 20634 - 20642
• a: 19.0333 ± 0.0014 Å
• b: 9.0499 ± 0.0007 Å
• c: 23.067 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3973.3 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0572
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.1522
• Weighted residual factors for all reflections included in the refinement: 0.1574
• Goodness-of-fit parameter for all reflections included in the refinement: 1.212
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No