Archive for November, 2025

Reinvestigating the reported transition state structure of a concerted triple H-tunneling mechanism.

Friday, November 21st, 2025

Substituting a deuterium isotope (2H) for a normal protium hydrogen isotope can slow the rate of a chemical reaction if this atom is involved in the reaction mode. The magnitude of the effect, referred to as a kinetic isotope effect or KIE is normally 2-7, but higher values of 20 or even more are sometimes observed due to a phenomenon known as proton tunnelling. So a recent report[1] of a 1H/2H of ~2440 for the following palladium catalysed reaction caught my eye:

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References

  1. Q. Wu, P. Liu, X. Zhang, C. Fan, Z. Chen, R. Qin, Y.Q. Gao, Y. Zhao, and N. Zheng, "Catalytic Hydrogenation Dominated by Concerted Hydrogen Tunneling at Room Temperature", ACS Central Science, vol. 11, pp. 2180-2187, 2025. https://doi.org/10.1021/acscentsci.5c00943