Browsing by Author "99873888-c460-4bf8-a3db-0e9702de95c7"
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Ormazábal-Toledo, Rodrigo; Richter, Sebastián; Robles Navarro, Andrés; Maulén Jara, Boris; Matute, Ricardo A.; Gallardo Fuentes, Sebastián (Royal Society of Chemistry, 2020)In this work we report a computational study about the aza-SNAr mechanism in fluorine- and chlorine-containing azines with the aim to unravel the physical factors that determine the reactivity patterns in these heterocycles ...
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Gallardo Fuentes, Sebastián; Ormazábal Toledo, Rodrigo (Elsevier, 2020)Frustrated Lewis Pairs (FLPs) are a prominent class of substances capable of activation of small molecules. Albeit several experimental and theoretical studies devoted to the activation of greenhouse gases were recently ...