Browsing by Subject "Computational Chemistry"
Now showing items 1-2 of 2
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Mechanism of a Metal Catalyzed Reaction from a Computational Quantum Mechanical Perspective
(East Carolina University, 2016-05-02)A recent study reported an innovative approach to the synthesis of the pharmaceutical drug, Clinprost. The authors found that the introduction of a palladium catalyst into the reaction scheme helped reduce the overall ... -
Theoretical Probe to the Mechanism of Pt-catalyzed C-H Acylation Reaction: Possible Pathways for the Key Acylation Reaction of Platinacycles
(East Carolina University, 2019-08-23)Transition metal-catalyzed C-H bond functionalization offers a variety of desirable transformations of simple hydrocarbons to more complex compounds with applications being applied in pharmaceuticals to material sciences. ...