Ms. Westwell et al., SUCCESSFUL PREDICTIONS OF THE RESIDUAL MOTION OF WEAKLY ASSOCIATED SPECIES AS A FUNCTION OF THE BONDING BETWEEN THEM, Journal of physical chemistry, 100(39), 1996, pp. 16000-16001
We demonstrate the utility of a specific form of a relationship betwee
n the bonding (enthalpy change) and restriction in motion (entropy cha
nge) for weak associations. This utility is illustrated through an ana
lysis of a collection of thermodynamic data for the interaction of mac
rocycles with neutral molecules (both in most cases with limited abili
ties to change their internal motions) in nonpolar media. By inspectio
n of the data in comparison to the trend that would be expected from t
his enthalpy/entropy compensation curve, we have successfully identifi
ed those points that either represent mistakes in transcription of dat
a from the original or incorrect measurements or in the context of the
discussion must be represented as associations rather than dissociati
ons.