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. 2021 Oct 16;14(20):6147. doi: 10.3390/ma14206147
NHC N-heterocyclic carbene
IR R-substituted imidazol-2-ylidene
Me methyl group
Et ethyl group
iPr isopropyl group
tBu tert-butyl group
Ph phenyl group
Tol 4-methylphenyl (toluene) group
Xyl 2,6-dimethylphenyl (xylene) group
Mes mesityl group
Dipp 2,6-diisopropylphenyl group
Ad adamantyl group
ESP electrostatic potential
QTAIM quantum theory of atoms in molecules
NCI non-covalent interaction (index/method)