Keyphrases
Binding Mode
100%
Phase Transfer
100%
Origin of Enantioselectivity
100%
Chalcone
100%
Cyanation
100%
Trifluoromethylated
100%
Industrial Application
25%
Computational Resources
25%
Main Drivers
25%
Density Functional Calculations
25%
Conformational Space
25%
Activation Barrier
25%
Transition Structure
25%
B3LYP-D3
25%
Constrained Optimization
25%
Ammonium
25%
Catalyzed Reaction
25%
Enolates
25%
R-enantiomer
25%
Complete Analysis
25%
Enantioselectivity
25%
1,4-addition
25%
Stacking Interactions
25%
Model Catalyst
25%
Enolate Alkylation
25%
Multistage Procedure
25%
Anionic nucleophile
25%
Conjugate Addition
25%
Bound System
25%
Strong Stabilization
25%
Syngenta
25%
Chemistry
Chalcone
100%
Enantioselectivity
100%
Enolates
66%
Enantiomer
33%
Density Functional Theory
33%
Hydrogen
33%
DFT-B3LYP Calculation
33%
Conformational Isomer
33%
Catalysis
33%
Alkylation
33%
Nucleophile
33%