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Temperature Dependence of the Dielectric Permittivity of Acetic Acid, Propionic Acid and Their Methyl Esters: A Molecular Dynamics Simulation Study

✍ Scribed by Sereina Riniker; Dr. Bruno A. C. Horta; Bram Thijssen; Saumya Gupta; Prof. Dr. Wilfred F. van Gunsteren; Prof. Dr. Philippe H. Hünenberger


Book ID
112069064
Publisher
John Wiley and Sons
Year
2012
Tongue
English
Weight
1012 KB
Volume
13
Category
Article
ISSN
1439-4235

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Molecular conformational changes in the
✍ P.T. Callaghan; K.W. Jolley 📂 Article 📅 1979 🏛 Elsevier Science 🌐 English ⚖ 415 KB

The temperature dependence of the 13 C chemical shifts in tristearin and methyl stearate has been investigated in both the melt and solution phases. Intramolecular conformational changes dominate the observed behaviour and there is little evidence for intermolecular interactions even in the melt pha