2025

1. A molecular electron density theory investigation of the mechanism of intramolecular [3+2] cycloaddition (32CA) with the participation of nitrile N-oxide and ethene molecular segments

   New Journal of Chemistry, Vol. 49, Núm. 18, pp. 7302-7313

2. Elucidating the mechanism and selectivity of [3 + 2] cycloaddition: a DFT and molecular docking investigation of the reaction of 6-butoxy-5,6-dihydro-4H-1,2-oxazine 2-oxide with dimethyl maleate

   Structural Chemistry, Vol. 36, Núm. 1, pp. 339-350

3. Mechanism and stereoselectivity of a [3 + 2] cycloaddition involving a glucosyl nitrone: a MEDT study

   Organic and Biomolecular Chemistry, Vol. 23, Núm. 20, pp. 5016-5032

4. Mechanistic insights into the regio- and stereoselectivity of [3+2] cycloaddition reactions between N-methyl-phenylnitrone and trans-1-chloro-2-nitroethylene within the framework of molecular electron density theory

   New Journal of Chemistry

5. Mechanistic study of the [2 + 2] cycloaddition of ethylene with ketene derivatives via MEDT

   Structural Chemistry

6. Unveiling Hydrogen Bonding and Solvent Effects on Directed Nitrile Oxide [3 + 2] Cycloaddition Reactions: Selectivity of 2,2-Dimethylpropane Nitrile Oxide with Cyclopentenylbenzamide: An MEDT Study

   ACS Omega, Vol. 10, Núm. 14, pp. 13868-13879