Unveiling the non-polar [3+2] cycloaddition reactions of cyclic nitrones with strained alkylidene cyclopropanes within a molecular electron density theory study

Author:

Domingo Luis R.1ORCID,Ríos-Gutiérrez Mar1ORCID,Chulan Rishikesh2,Mahmoud M. H. H.3,Ibrahim Mohamed M.3,El-Bahy Salah M.4,Rhyman Lydia25ORCID,Ramasami Ponnadurai25ORCID

Affiliation:

1. Department of Organic Chemistry, University of Valencia, Dr Moliner 50, E-46100 Burjassot, Valencia, Spain

2. Computational Chemistry Group, Department of Chemistry, Faculty of Science, University of Mauritius, Réduit 80837, Mauritius

3. Department of Chemistry, College of Science, Taif University, P.O. Box 11099, Taif 21944, Saudi Arabia

4. Department of Chemistry, Turabah University College, Taif University, P.O. Box 11099, Taif 21944, Saudi Arabia

5. Centre for Natural Product Research, Department of Chemical Sciences, University of Johannesburg, Doornfontein, Johannesburg 2028, South Africa

Abstract

The role of cyclopropane substitution on the ethylene in zw-type [3+2] cycloaddition (32CA) reactions of cyclic nitrones has been studied within Molecular Electron Density Theory (MEDT) at the ωB97X-D/6-311G(d,p) computational level.

Funder

Ministerio de Ciencia e Innovación

Taif University

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Reference47 articles.

1. W.Carruthers , in Some Modern Methods of Organic Synthesis , Cambridge University , Cambridge, UK , 1978

2. A.Padwa , in 1,3-Dipolar Cycloaddition Chemistry , Wiley-Interscience , New York, NY, USA , 1984 , vol. 1–2

3. W.Carruthers , in Cycloaddition Reactions in Organic Synthesis , Pergamon , Oxford, UK , 1990

4. A.Padwa and W. H.Pearson , in Synthetic Applications of 1,3-Dipolar Cycloaddition Chemistry Toward Heterocycles and Natural Products , John Wiley & Sons, Inc. , New York, NY, USA , 2002 , vol. 59

5. R. C. F.Jones and J. N.Martin , in Synthetic Application of 1,3-Dipolar Cycloaddition Chemistry Toward Heterocycles and Natural Products , ed. A. Padwa and W. H. Pearson , Wiley , New York 2002 , pp. 1–8

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