Concepedia

Influence of tunnelling on the ratio of the activation rate constants of C C and C H bonds in ethane by a bare palladium atom

V. M. Mamaev, Igor P. Gloriozov, Andrew V. Prisyajnyuk, Yury A. Ustynyuk

Mendeleev Communications · 1996 · 10 citations · 8 references

DOI

Concepts

Abstract

Dynamic modeling of ethane oxidative insertion to a bare palladium atom at both CC and CH bonds has demonstrated the influence of quantum effects in the more growth of the rate constant of CH bond activation compared to CC activation.

References

8

Carbon-hydrogen and hydrogen-hydrogen activation in transition metal complexes and on surfaces

Jean Yves Saillard, Roald Hoffmann · Journal of the American Chemical Society · 1984 · 601 citations

, , +16

Activation of saturated hydrocarbons by transition metal complexes

Robert H. Crabtree · Journal of Molecular Catalysis · 1985 · 296 citations

, , +12

Theoretical studies of oxidative addition and reductive elimination. 2. Reductive coupling of hydrogen-hydrogen, hydrogen-carbon, and carbon-carbon bonds from palladium and platinum complexes

John J. Low, William A. Goddard · Organometallics · 1986 · 233 citations

, , +15

Reaction-path dynamics for polyatomic systems

William H. Miller · The Journal of Physical Chemistry · 1983 · 154 citations · Full text

, , +5

Theoretical study of the activation of alkane carbon-hydrogen and carbon-carbon bonds by different transition metals

Margareta R. A. Blomberg, Per E. M. Siegbahn, Umpei Nagashima et al. · Journal of the American Chemical Society · 1991 · 151 citations

, , +13