Information card for entry 1544182

Structure parameters

• Formula: C105 H192 Dy4 N12 O24
• Calculated formula: C105 H192 Dy4 N12 O24
• Title of publication: Exchange-bias quantum tunnelling in a CO2-based Dy4-single molecule magnet.
• Authors of publication: Pineda, Eufemio Moreno; Lan, Yanhua; Fuhr, Olaf; Wernsdorfer, Wolfgang; Ruben, Mario
• Journal of publication: Chemical science
• Year of publication: 2017
• Journal volume: 8
• Journal issue: 2
• Pages of publication: 1178 - 1185
• a: 28.1117 ± 0.0011 Å
• b: 20.1279 ± 0.0006 Å
• c: 22.8674 ± 0.001 Å
• α: 90°
• β: 105.985 ± 0.003°
• γ: 90°
• Cell volume: 12438.7 ± 0.8 ų
• Cell temperature: 180.15 K
• Ambient diffraction temperature: 180.15 K
• Number of distinct elements: 5
• 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: 0.0922
• Residual factor for significantly intense reflections: 0.0723
• Weighted residual factors for significantly intense reflections: 0.187
• Weighted residual factors for all reflections included in the refinement: 0.2095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.002
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No