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NMR study of ε-caprolactam in various solvents. Graphical determination of monomer shift, dimer shift and dimerization constant from the dilution shift data
Author(s) -
JennShing Chen
Publication year - 1994
Publication title -
journal of the chemical society faraday transactions
Language(s) - English
Resource type - Journals
eISSN - 1364-5455
pISSN - 0956-5000
DOI - 10.1039/ft9949000717
Subject(s) - dimer , chemistry , dilution , caprolactam , enthalpy , monomer , chloroform , acetonitrile , extrapolation , acetone , analytical chemistry (journal) , thermodynamics , organic chemistry , polymer , physics , mathematical analysis , mathematics
A graphical method for the simultaneous determination of the monomer shift, dimer shift and dimerization constant of a self-association system from the dilution NMR shift data is proposed. This method avoids the conventional extrapolation to infinite dilution to obtain the monomer shift. Three self-association systems: Iµ-caprolactam in [2H1]chloroform, [2H6]acetone and [2H3]acetonitrile were studied at various temperatures. The enthalpy and entropy of dimerization were also determined from van't Hoff plots.

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