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Table 4

Crossover temperatures (Tc in K) and reaction rate-constants k(Tmin, in s−1) at the lowest temperature achieved in our calculations (Tmin in K), for the exothermic reactions starting from C2H4.

Reaction Tc(K) Tmin (K) k(Tmin) (s−1)
C2H4 + H → C2H5 168 40 1.2 × 106
C2H4 + OH → C2H4OH 49 49 1.4 × 106, (a)
C2H4 + OH → C2H3 + H20 354 40 5.6 × 101
C2H4 + NH2 → C2H4NH2 93 30 2.6 × 10−3
C2H4 + CH3 → C2H4CH3 121 30 2.5 × 10−12

Notes. (a)Instanton rate constants did not converge below Tc and an Eckart barrier estimate of the rate constant at 30 K is k(30 K) = 1.18 × 104 s−1.

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