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1,3-Dipolar cycloadditions. Part-XVI Frontier molecular orbitals of C-aryl-N-methyl nitrones1'2 - A DFT study
2009
Zenodo
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Centre of Advanced Studies on Natural Products including Organic Synthesis, Department of Chemistry, University College of Science, University of Calcutta, 92, Acharya Prafulla Chandra Road, Kolkata-700 009, India E-mail : ablabcu@yahoo.co.uk Manuscript received I April 2009, accepted 3 June 2009 Molecular orbital calculations have been performed by OFT calculations using B3LYP theory and 6-31 G (d) level of approximation for C-(4-chlorophenyl)-N-methyl nitrone on the basis of its optimised
doi:10.5281/zenodo.5820487
fatcat:twhvexaknrdlrjqi4aqlpfzifu