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Giuseppe Cucinotta, Mauro Perfetti, Dr. Javier Luzon, Dr. Mael Etienne, Dr. Pierre-Emmanuel Car, Prof. Dr. Andrea Caneschi, Dr. Guillaume Calvez, Dr. Kevin Bernot and Prof. Dr. Roberta Sessoli Magnetic Anisotropy in a Dysprosium/DOTA Single-Molecule Magnet: Beyond Simple Magneto-Structural Correlations Angewandte Chemie International Edition 51

Version of Record online: 12 JAN 2012 | DOI: 10.1002/anie.201107453

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Magnetic moments: The orientation of the title single-molecule magnet was investigated by magnetic single crystal and luminescence characterization, supported by ab initio calculations, and was found to be governed by the position of the hydrogen atoms of the apical water molecules. This finding suggests that simple magneto-structural correlations can give misleading clues for research in molecular magnetism as well as in the design of MRI contrast agents.

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