INIS
atoms
100%
reaction mechanisms
87%
density functional method
75%
investigations
66%
levels
66%
bonding
66%
thermodynamics
66%
cleavage
58%
electron density
58%
populations
54%
nitrogen
50%
stability
50%
oxides
50%
topology
41%
carbon
41%
protons
41%
energy
41%
double bonds
41%
kinetics
37%
free enthalpy
37%
synthesis
33%
glycerol
33%
decarboxylation
33%
reactivity
33%
decomposition
33%
acidity
33%
boron
33%
gibbs free energy
33%
carbonates
33%
boron compounds
33%
purines
33%
nitriles
33%
enthalpy
29%
molecules
25%
coordinates
20%
correlations
20%
solvents
20%
values
16%
electrons
16%
catalysts
16%
functionals
16%
amines
16%
aromatics
16%
isocyanates
16%
phosphorus
16%
lewis acids
16%
benzothiazoles
16%
transformations
16%
cyclization
16%
toluene
16%
Keyphrases
Nitrile Oxide
33%
Unsaturated Nitriles
33%
Diazomethane
33%
Cycloaddition Reaction
33%
Trien
33%
3-Ylideneoxindoles
33%
Bond Evolution
33%
Molecular Electron Density Theory
33%
Allyloxy
33%
Evolution Theory
33%
Tricarbonyl Complexes
33%
Chromium Tricarbonyl
33%
Triptycene
33%
2-Methylbenzothiazole
33%
Glycerol Carbonate
33%
Intramolecular aza-Wittig Reaction
33%
Carbonate Decomposition
33%
3-hydroxypropanal
33%
Purine Bases
33%
Thermodynamic Evolution
33%
Bonding Evolution Theory
33%
Thiotepa
33%
Pseudoradical Centers
25%
Reaction Energy
16%
Global Mechanism
16%
Intramolecular Cyclization
16%
DFT Functionals
16%
Reaction Channel
16%
1,3-Dioxolan-2-ones
16%
Reaction Enthalpy
16%
C-O Bond Formation
16%
Single Bond
16%
OH Bond
16%
Electron Population
16%
Kinetic Product
16%
Reaction Coordinate
16%
Exocyclic Amines
16%
Proton Migration
16%
P-N Bond
16%
Base Solvent
16%
Competitive Pathway
16%
Iminophosphorane
16%
Thermodynamic Product
16%
Phospholene
16%
Boron Lewis Acid
11%
Pyramidalization
11%
Carbon-halogen Bond
11%
Aryl Rings
11%
Electron Localization Function
8%
C2-C3
8%
