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. 2014 Aug 25;111(36):13052–13056. doi: 10.1073/pnas.1414556111

Table 1.

Normalized hydration energetics (kcal/mol at 25 °C)

Solute −TΔSo/n ΔHo/n ΔGo/n
Data set I
 Methane 0.227 −0.128 0.098
 Ethane 0.259 −0.179 0.079
 Propane 0.256 −0.184 0.072
 Isobutane 0.249 −0.173 0.077
 Neopentane 0.249 −0.170 0.078
Data set II
 Ethane 0.261 −0.182 0.080
 Propane 0.249 −0.177 0.072
 Butane 0.259 −0.189 0.070

Hydration free energy (ΔGo), enthalpy (ΔHo), and entropy (ΔSo) for the hydration of gaseous alkanes; T is degrees K. The standard state is the one proposed by Ben-Naim (16) for solute transfer between fixed positions in the gas and liquid phases. n is the number of water molecules correlated with the alkane by vdw attraction, taken from ref. 13. ASA is the solvent-accessible surface area in Å2, using the vdw radii given in ref. 19.