Reactions

ΔEr

(kcal/mol)

ΔHr

(kcal/mol)

ΔGr

(kcal/mol)

ΔCr

(kcal/mol-Kelvin)

ΔSr

(kcal/mol-Kelvin)

NAPA-A + H2O → [NAPA-A(H2O)1]

−9.27

−9.87

−0.52

0.0030

−0.0313

[NAPA-A(H2O)1] + H2O → [NAPA-A(H2O)2]

−12.77

−13.36

−2.86

0.0025

−0.0352

[NAPA-A(H2O)2] + H2O → [NAPA-A(H2O)3]

−8.00

−8.60

0.08

0.0034

−0.0291

[NAPA-A(H2O)3] + H2O → [NAPA-A(H2O)4]

−5.68

−6.27

1.86

0.0041

−0.0272