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Predicting thermochemical parameters of oxygen-containing heterocycles using simple QSPR models |
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| Authors: | N Adams J Clauss M Meunier |
| Institution: | 1. Eindhoven University of Technology and Dutch Polymer Institute, Laboratory of Macromolecular Chemistry and Nanoscience , P.O. Box 513, Eindhoven, 5600, MB, The Netherlands;2. Ticona GmbH, Core Technology , Professor-Staudinger-Strasse, Kelsterbach, 65451, Germany;3. Accelrys Ltd , 334 Cambridge Science Park, Cambridge, CB4 0WN, UK |
| Abstract: | |
| Keywords: | Thermochemistry QSPR Enthalpy of formation Entropy of formation Heat capacity Heterocycles |