T (K)

ΔΔH (kcal/

mol) fwd

ΔΔH (kcal/

mol) rev

Q (kcal/

mol)

ΔΔG (kcal/

mol) fwd

ΔΔG (kcal/

mol) rev

First stage of elementary act

300

30.91

16.33

14.58

34.49

17.08

400

30.64

16.21

14.43

35.73

17.36

500

30.45

16.07

14.38

37.02

17.66

600

31.1

11.3

19.8

38.35

17.99

623

30.29

15.94

14.35

38.66

18.07

First stage of elementary act

300

11.78

31.65

−19.87

12.58

35.69

400

11.62

31.42

−19.8

12.87

37.07

500

11.45

31.23

−19.78

13.2

38.5

600

11.3

31.1

−19.8

13.57

39.97

623

11.27

31.07

−19.8

13.65

40.31