1971
DOI: 10.1021/ja00752a010
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Four-parameter equation for predicting enthalpies of adduct formation

Abstract: A computer-fitted set of parameters for acids and bases is presented which accurately correlates over 280 enthalpies of adduct formation. The parameters can be used to predict over 1200 enthalpies of interaction. A matrix formulation of the problem is presented to illustrate the relationship among the various solutions to this problem. Our selection of a particular solution is justified on the basis of our intuitive understanding of the nature of molecular interactions. Means of transforming this solution to a… Show more

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Cited by 435 publications
(177 citation statements)
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“…For the acid-base interacting liquids, the exact values of Δv ab were calculated by the deviation from the linear relationship satisfied in non-interacting liquids [27]. On the basis of quantum mechanics, Drago [28] explained the linear relationship between enthalpy of adduct formation and the shift in the frequency of vibration:…”
Section: Fig 3 Heat Of Mixing H M /(N X + N Z ) Vs Molar Fraction mentioning
confidence: 99%
“…For the acid-base interacting liquids, the exact values of Δv ab were calculated by the deviation from the linear relationship satisfied in non-interacting liquids [27]. On the basis of quantum mechanics, Drago [28] explained the linear relationship between enthalpy of adduct formation and the shift in the frequency of vibration:…”
Section: Fig 3 Heat Of Mixing H M /(N X + N Z ) Vs Molar Fraction mentioning
confidence: 99%
“…The Edwards equation (26), the Drago equation (27), and Pearson's concept of hardness and softness of acids and bases (28) are familiar attempts to correlate reactivities, quantitatively or qualitatively, in terms of the minimal four parameters.…”
Section: Introductionmentioning
confidence: 99%
“…The enthalpy of acid-base interaction, ΔH ab , necessary for the determination of the specific component of the reversible work of adhesion, can be calculated from the acid-base constants of the interacting phases by using the theory of Drago [179] or Guttman [180].…”
Section: Type and Strength Of Interactionmentioning
confidence: 99%