Reactivity and Selectivity of the Diels-Alder Reaction of Anthracene in [Pd6L4]12+ Supramolecular Cages: A Computational Study.
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DOI: 10.1021/acs.inorgchem.3c00005
Abstract: The field of supramolecular metal-organic cage catalysis has grown rapidly in recent years. However, theoretical studies regarding the reaction mechanism and reactivity and selectivity controlling factors for supramolecular catalysis are still underdeveloped. Herein, we demonstrate… read more here.
Keywords: reaction; diels alder; pd6l4 supramolecular; alder reaction ... See more keywords