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The Mechanism And Regioselectivities Of (NHC)nickel(ii)hydride-catalyzed Cycloisomerization Of Dienes: A Computational Study

Yuan Gao, K. N. Houk, Chun-Yu Ho, Xin Hong

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Computation elucidates the mechanism and origins of regioselectivity of (NHC)Ni(ii)hydride-catalyzed cycloisomerization of dienes.