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Table 2 Reaction energy barrier of IM5b and 1O2 in twelve possible reaction pathways unit: Kcal/mol

From: The mechanism for enhanced oxidation degradation of dioxin-like PCBs (PCB-77) in the atmosphere by the solvation effect

Energy barrier

a1

a2

c1

c2

c3

c4

d1

∆E

1.01

0.88

20.02

32.94

17.02

18.7

11.86

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BMC Chemistry

ISSN: 2661-801X

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