Information card for entry 7700724

Structure parameters

• Formula: C56 H56.97 Cl4 Dy2 I2 N8 O6.48
• Calculated formula: C56 H56.96 Cl4 Dy2 I2 N8 O6.48
• Title of publication: Enhancing single-molecule magnet behaviour through decorating terminal ligands in Dy₂ compounds.
• Authors of publication: Ma, Xiufang; Chen, Bingbing; Zhang, Yi-Quan; Yang, Jinhui; Shi, Quan; Ma, Yulong; Liu, Xiangyu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 33
• Pages of publication: 12622 - 12631
• a: 11.8909 ± 0.0008 Å
• b: 17.032 ± 0.0009 Å
• c: 15.4647 ± 0.001 Å
• α: 90°
• β: 107.506 ± 0.002°
• γ: 90°
• Cell volume: 2986.9 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• 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: 0.0968
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.0846
• Weighted residual factors for all reflections included in the refinement: 0.0998
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No