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. 2022 Jul 1;7(27):24004–24011. doi: 10.1021/acsomega.2c02974

Table 4. Calculated ΔG, λ, (kcal mol–1), Diffusion-Limited Rate Constant (kD), kapp, and kf (M–1 s–1) of the Reaction Between AS and Chosen Radicals in Aqueous Solution at pH 7.4a.

radicals ΔG λ kD kapp kfb
HO 18.7 4.4 8.50 × 109 1.20 × 10–1 2.40 × 10–4
CH3O 0.0 5.6 8.10 × 109 8.10 × 109 1.62 × 107
CCl3O 17.5 22.2 7.60 × 109 9.30 × 10–1 1.86 × 10–3
HOO 3.8 16.4 8.20 × 109 4.50 × 109 9.00 × 106
CH3OO 4.6 15.8 8.00 × 109 2.00 × 109 4.00 × 106
CCl3OO 0.2 17.9 7.60 × 109 7.60 × 109 1.52 × 107
NO 79.4 15.3 8.30 × 109 3.90 × 1046 7.80 × 1049
NO2 0.5 28.8 8.10 × 109 8.10 × 109 1.62 × 107
O2•– 43.0 18.2 7.20 × 109 1.80 × 1019 3.60 × 1022
SO4•– 8.90 18.6 7.90 × 109 2.00 × 106 4.00 × 103
N3 20.3 3.5 7.00 × 109 8.10 × 10–3 1.62 × 10–5
a

According to the SET reaction.

b

kf = f·kapp and f(AS) = 0.002.