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. 2022 Jun 30;7(27):23611–23623. doi: 10.1021/acsomega.2c02217

Table 5. Coefficients of Equilibrium Constants Estimated in the Present Worka.

system aq (MDEA + 2-MPZ)
aq ([bmim] [Ac] + 2-MPZ)
aq (TMSO2 + 2-MPZ)
Ki/kmol.m–3 K4 K5 K4 K5 K6 K7 K4 K5
G –3.216 × 10–8 4.174×105 –9.782 × 10–9 –2.485×103 –9.795 × 10–9 –2.513×103 2.586 × 10–5 –5.439×104
H –1.261 × 10–9 9.951 × 10 –4.436 × 10–9 –4.826×103 –4.436 × 10–9 –4.840×103 –2.399 × 10–5 –5.814 × 10
K 1.024 × 10–10 5.933 × 10 6.745 × 10–11 –5.974 × 10 6.740 × 10–11 –5.990 × 10 2.492 × 10–8 5.817×103
L 6.755 × 10–12 –3.978 –2.327 × 10–11 –1.627×103 –2.328 × 10–11 –1.619×103 –7.333 × 10–9 –4.496×102
N 2.168 × 10–14 –5.624 2.612 × 10–13 5.822 2.597 × 10–13 5.830 –5.254 × 10–11 –1.541 × 10
P –7.678 × 10–13 –3.410 × 10–2 1.131 × 10–10 –5.177 × 10–2 1.132 × 10–10 –5.164 × 10–2 9.969 × 10–10 –2.062 × 10
Q 2.728 × 10–14 1.885 × 10–2 1.555 × 10–24 9.442×102 1.563 × 10–24 9.453×102 –3.294 × 10–13 1.014×103
R   –1.799 × 10–4   –1.359 × 10–3   –1.388 × 10–3   –7.680 × 10–2
% AAD 7.53     22.49     31.94  
a

The competency of the modified KE model for prediction of CO2 solubility is also presented in terms of residual plots for the aq (MDEA + 2-MPZ) system in Figure 3.