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How Alkali Cations Catalyze Aromatic Diels-Alder Reactions
Pascal Vermeeren
, Francine Brinkhuis
, Trevor A. Hamlin
,
F. Matthias Bickelhaupt
Vrije Universiteit Amsterdam
Radboud University Nijmegen
Research output
:
Contribution to journal
›
Article
›
peer-review
22
Citations (Scopus)
Overview
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Keyphrases
Aromatics
100%
Diels-Alder Reaction
100%
Alkali Cations
100%
Reaction Barrier
40%
Benzene
20%
Polycyclic Aromatic Hydrocarbons
20%
Bonding Analysis
20%
Molecular Orbital
20%
Order of Magnitude
20%
Li +
20%
Na +
20%
Acetylene
20%
Lewis Acid Catalysis
20%
Pauli Repulsion
20%
Dienes
20%
Uncatalyzed Reaction
20%
Activation Strain
20%
Pauli
20%
Cs +
20%
Dispersion-corrected Density Functional Theory (DFT-D)
20%
Competing Mechanisms
20%
Dienophile
20%
Closed Shell
20%
Chemistry
Diels-Alder Reaction
100%
Polycyclic Aromatic Hydrocarbons
25%
Molecular Orbital
25%
Lewis Acid
25%
Acid Catalysis
25%
formation
25%
Benzene
25%
Density Functional Theory
25%
Potassium Ion
25%
Cesium Ion
25%