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. Author manuscript; available in PMC: 2021 May 26.
Published in final edited form as: Chem. 2020 Oct 1;6(10):2810–2825. doi: 10.1016/j.chempr.2020.09.004

Fig. 5.

Fig. 5

Computational predictions of compatibility of electrophiles (EY) in the Pd/NBE-catalyzed reactions with ortho-ethyl iodobenzene (ArX-1). a Ar1 = 2,6-dimethylphenyl. b All energies are in kcal/mol with respect to Pd0 or ANP-4. c Electrophile compatibility score between each electrophile and ArX-1. d Experimental yields from refs. 26, 38, 34, 31, 39 were from reactions with 2-iodotoluene unless otherwise noted. e Experimental yield was from the reaction with 2-bromoanisole.