Browsing by Subject "Quinoxaline"

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Reaction Mechanism of 2-monosubstituted Quinoxalines with Organolithium Compounds : a Theoretical Study

Moagi, Kgotso Herbet (University of Pretoria, 2020)

This dissertation describes the density functional theory (DFT) computational modelling of reactions between organolithium nucleophiles and various substituted quinoxalines. These reactions result in the functionalisation ...
A REP-FAMSEC method as a tool in explaining reaction mechanisms : a nucleophilic substitution of 2-phenylquinoxaline as a DFT case study

Mdhluli, Brian Kamogelo; Nxumalo, Winston; Cukrowski, Ignacy (MDPI, 2021-03-12)

In search for the cause leading to low reaction yields, each step along the reaction energy profile computed for the assumed oxidative nucleophilic substitution of hydrogen (ONSH) reaction between 2‑phenylquinoxaline and ...

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