@article{MAKHILLAJIT20141375840,
    title = {Theoretical Study of Ene-Reaction of Allylic Grignard Reagents},
    journal = {Asian Journal of Information Technology},
    volume = {13},
    number = {7},
    pages = {363-367},
    year = {2014},
    issn = {1682-3915},
    doi = {ajit.2014.363.367},
    url = {https://makhillpublications.co/view-article.php?issn=1682-3915&doi=ajit.2014.363.367},
    author = {Elahe and},
    keywords = {Mg-ene reaction,Grignard reagents,organometal molecule,ab initio calculations,molecular modeling},
    abstract = {The allyl compounds of Mg, react with an olefin by inversion 
  of the allyl group via a six center transition state. These precyclic reactions 
  may be one of the most important classes of organic reactions. The reactions 
  of propenyl magnesium halides with ethylene were studied using <I>ab initio</I> 
  calculations. The methods used for calculations are RHF, B3LYP and MP2 with 
  6-31G* basis set. Researchers have investigated the structural properties, theoretical 
  thermodynamic and kinetic data, i.e., rate constants of the reactions.}
    }