Publicacións nas que colabora con LUIS RAMON DOMINGO ASENSI (99)

2024

  1. A molecular electron density theory study of hydrogen bond catalysed polar Diels–Alder reactions of α,β-unsaturated carbonyl compounds

    Tetrahedron Chem, Vol. 10

  2. A molecular electron density theory study of the bimolecular nucleophilic substitution reactions on monosubstituted methyl compounds

    Organic and Biomolecular Chemistry, Vol. 22, Núm. 36, pp. 7425-7437

  3. MEDT analysis of mechanism and selectivities in non-catalyzed and lewis acid-catalyzed diels–alder reactions between R-carvone and isoprene

    Scientific Reports, Vol. 14, Núm. 1

  4. Revealing the Critical Role of Global Electron Density Transfer in the Reaction Rate of Polar Organic Reactions within Molecular Electron Density Theory

    Molecules, Vol. 29, Núm. 8

  5. Understanding the Electronic Effects of Lewis Acid Catalysts in Accelerating Polar Diels-Alder Reactions

    Journal of Organic Chemistry

2023

  1. A MEDT study of the mechanism and selectivity of the hetero-Diels–Alder reaction between 3-benzoylpyrrolo[1,2-c][1,4]-benzoxazine-1,2,4-trione and vinyl acetate

    Chemistry of Heterocyclic Compounds, Vol. 59, Núm. 3, pp. 165-170

  2. A Molecular Electron Density Theory Study of the Domino Reaction of N-Phenyl Iminoboranes with Benzaldehyde Yielding Fused Bicyclic Compounds

    Molecules, Vol. 28, Núm. 17

  3. A Molecular Electron Density Theory Study of the Polar Diels-Alder Reaction of Naphtoquinone:Cr(CO)3 Complex with Cyclic Dienes

    Polycyclic Aromatic Compounds, Vol. 43, Núm. 9, pp. 8065-8081

  4. A combined BET and IQA-REG study of the activation energy of non-polar zw-type [3+2] cycloaddition reactions

    Physical Chemistry Chemical Physics, Vol. 25, Núm. 15, pp. 10853-10865

  5. A novel alpha-amylase inhibitor-based spirooxindole-pyrrolidine-clubbed thiochromene-pyrzaole pharmacophores: Unveiling the [3+2] cycloaddition reaction by molecular electron density theory

    Chemical Biology and Drug Design, Vol. 102, Núm. 5, pp. 972-995

  6. Electrophilicity and nucleophilicity scales at different DFT computational levels

    Journal of Physical Organic Chemistry, Vol. 36, Núm. 7

  7. Why is phenyl azide so unreactive in [3 + 2] cycloaddition reactions? Demystifying Sustmann's paradigmatic parabola

    Organic Chemistry Frontiers, Vol. 10, Núm. 22, pp. 5579-5591

2022

  1. A Molecular Electron Density Theory Study of the Lewis Acid Catalyzed [3+2] Cycloaddition Reactions of Nitrones with Nucleophilic Ethylenes

    European Journal of Organic Chemistry, Vol. 2022, Núm. 3

  2. A Molecular Electron Density Theory Study of the [3+2] Cycloaddition Reaction of an Azomethine Ylide with an Electrophilic Ethylene Linked to Triazole and Ferrocene Units

    Molecules, Vol. 27, Núm. 19

  3. Application of Reactivity Indices in the Study of Polar Diels-Alder Reactions

    Conceptual Density Functional Theory: Towards a New Chemical Reactivity Theory: Volume 1 (wiley), pp. 481-502

  4. Does Cr(CO)3 Really behave as Catalyst in the Diels-Alder Reaction of Styrene with Cyclopentadiene? A Molecular Electron Density Theory Study

    ChemistrySelect, Vol. 7, Núm. 24

  5. Unveiling the Chemistry of Higher-Order Cycloaddition Reactions within the Molecular Electron Density Theory

    Chemistry (Switzerland), Vol. 4, Núm. 3, pp. 735-752

  6. Unveiling the cb-type Intramolecular [3+2] Cycloaddition Reactions of Fluorinated Azomethine Ylides to Ester Carbonyls with a Molecular Electron Density Theory Perspective

    ChemistrySelect, Vol. 7, Núm. 24

  7. Unveiling the high reactivity of experimental pseudodiradical azomethine ylides within molecular electron density theory

    Physical Chemistry Chemical Physics, Vol. 25, Núm. 1, pp. 314-325

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

    RSC Advances, Vol. 12, Núm. 39, pp. 25354-25363