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Donor-acceptor-interactions, enthalpies prediction

These qualitative explanations, whether they be hard-soft or ionic-covalent or Class A-Class B, all suffer from the arbitrary way in which they can be employed. All Lewis acid-base type interactions are composed of some electrostatic and some covalent properties, i.e., hardness and softness are not mutually exclusive properties. Predictions are straightforward when dealing with the extremes, but with other more ambiguous systems, one can be very arbitrary in explaining results and the predictive value is impaired. What is needed is a quantitative assessment of the essential factors which can contribute to donor strength and acceptor strength. Proper combination of these parameters should produce the enthalpy of adduct formation. Until this can be accomplished, one could even question the often made assumption that the strength of the donor-acceptor interaction is a function of the individual properties of a donor or acceptor. [Pg.90]


See other pages where Donor-acceptor-interactions, enthalpies prediction is mentioned: [Pg.55]    [Pg.55]    [Pg.320]    [Pg.69]    [Pg.39]    [Pg.66]    [Pg.112]    [Pg.514]    [Pg.117]    [Pg.559]    [Pg.70]    [Pg.529]    [Pg.346]    [Pg.32]    [Pg.254]    [Pg.65]   
See also in sourсe #XX -- [ Pg.20 ]




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Donor-acceptor-interactions, enthalpies

Enthalpy predictions

Interactions enthalpy

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