A molecular electron density theory study of the chemo- and regioselective [3 + 2] cycloaddition reactions between trifluoroacetonitrile N-oxide and thioketones

2018 ◽  
Vol 501 ◽  
pp. 128-137 ◽  
Author(s):  
Saeedreza Emamian ◽  
Tian Lu ◽  
Luis. R. Domingo ◽  
Leily Heidarpoor Saremi ◽  
Mar Ríos-Gutiérrez
RSC Advances ◽  
2017 ◽  
Vol 7 (25) ◽  
pp. 15586-15595 ◽  
Author(s):  
Luis R. Domingo ◽  
Mar Ríos-Gutiérrez ◽  
Saeedreza Emamian

The domino reaction between 1-diazopropan-2-one and 1,1-dinitroethylene yielding a pyrazole and a gem-dinitrocyclopropane has been studied using molecular electron density theory.


2021 ◽  
Author(s):  
Luis R. Domingo ◽  
Patricia Perez

The higher–order cycloaddition reactions of tropone with nucleophilic ethylenes, in the absence and presence of Lewis acid (LA) catalysts, have been studied within Molecular Electron Density Theory (MEDT) at the...


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