Orbital Signatures as a Descriptor of Regioselectivity and Chemical Reactivity: The Role of the Frontier Orbitals on 1,3-Dipolar Cycloadditions
Author:
Affiliation:
1. Department of Chemistry, Federal University of Lavras, CEP 37200-000 Lavras, Minas Gerais, Brazil
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp108790w
Reference64 articles.
1. A theoretical study on the regioselectivity of 1,3-dipolar cycloadditions using DFT-based reactivity indexes
2. A DFT study for the regioselective 1,3-dipolar cycloadditions of nitrile N-oxides toward alkynylboronates
3. Advances in Solid-Phase Cycloadditions for Heterocyclic Synthesis
4. A Molecular Orbital Theory of Reactivity in Aromatic Hydrocarbons
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