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- W2078274420 abstract "In this paper we attempt to explain the unusual isotope effect displayed by the 1H-NMR scalar H-H coupling of the hydrides in complexes [CpIrL(H)3]+ (L=various phosphine and phosphite ligands) when one of the equivalent protons is turned into a deuteron (D.M. Heinekey, J.M. Millar, T.F. Koetzle, N.G. Payne, and K.W. Zilm, J. Am. Chem. Soc. 112, 909 (1990)]. It is found that in the case of the perprotio species the system can be described as a three-coupled well system, but when a deuterium is introduced the system is better described as a double-coupled well. Finally, it is shown that the coupling in the case of a double-well system is greater than in an equivalent triple-well system, in this way giving a plausible explanation to the experimental facts reported." @default.
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- W2078274420 date "1998-03-01" @default.
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- W2078274420 title "On the unexpected isotope effect on the exchange coupling constant in partially deuterated transition-metal trihydride complexes" @default.
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- W2078274420 doi "https://doi.org/10.1002/bbpc.19981020311" @default.
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