Information card for entry 1564806

Structure parameters

• Formula: C40 H32 Dy2 N6 O18
• Calculated formula: C40 H32 Dy2 N6 O18
• SMILES: C1c2cccc3c2[O]2[Dy]45678([N]=1NC(=[O]4)c1occc1)(ON(=[O]5)=O)[O]=C(O[Dy]1452([O]3C)([N](=Cc2cccc(c2[O]61)[O]7C)NC(=[O]4)c1occc1)(ON(=[O]5)=O)[O]=C(O8)c1ccccc1)c1ccccc1
• Title of publication: Exchange-Bias Quantum Tunneling of the Magnetization in a Dysprosium Dimer.
• Authors of publication: Dolai, Malay; Moreno-Pineda, Eufemio; Wernsdorfer, Wolfgang; Ali, Mahammad; Ghosh, Ashutosh
• Journal of publication: The journal of physical chemistry. A
• Year of publication: 2021
• Journal volume: 125
• Journal issue: 37
• Pages of publication: 8230 - 8237
• a: 10.5497 ± 0.0014 Å
• b: 17.112 ± 0.002 Å
• c: 12.0241 ± 0.0016 Å
• α: 90°
• β: 100.401 ± 0.006°
• γ: 90°
• Cell volume: 2135 ± 0.5 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0794
• Residual factor for significantly intense reflections: 0.0613
• Weighted residual factors for significantly intense reflections: 0.1511
• Weighted residual factors for all reflections included in the refinement: 0.1667
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No