Research Area: Theoretical Organic
Chemistry-Study of strained molecules, reactive
intermediates and of anti-vant Hoff geometries
using quantum mechanical and force field methods.
Collaborating Institutions:
NCL, Pune
Research Publications (selected)
1. Reaction of 2-formylbenzenesulphonyl chlorides
with amiens: Experimental and theoretical
studies on the structures
of 2-formylbenzenesulphonyl chloridesin solid,solution
and gas phases,K.G.Rajeeve, S.M. Sasidhar,
K.Pius and M.V.Bhatt,
Tetrahedron,50 (1994),5425.
2. Ab initio study of conjugative and
negative hypreconjugative interactions in
disubstituted radicals, K.Pius, M.Jain and
J.Chandrasekhar, J. Mol. Struct. (theohem.),361,(1996)
191.
3. Remarkably large cahtodative stabilization
in radical ions, K.Piusand J.Chandrasekhar,
J.Chem.Soc. Chem.soc., chem.
Commun. (1990) 41