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How Well Can Theory Predict Addition-Fragmentation Equilibrium Constants in RAFT Polymerization?

Date

Authors

Lin, Ching-Yeh

Coote, Michelle

Publisher

CSIRO Publishing

Abstract

High level ab initio molecular orbital calculations are used to study the additionfragmentation equilibrium constants of S-S'-bis(methyl-2-propionate)- trithiocarbonate mediated polymerization of methyl acrylate in toluene at 30°C. The results, which sho

Keywords

Keywords: Ab initio molecular orbital calculation; Addition-fragmentation; Methyl acrylates; Order of magnitude; RAft polymerization; Related systems; Trithiocarbonate; Acrylic monomers; Living polymerization; Molecular orbitals; Polymethyl methacrylates; Toluene;

URI

http://hdl.handle.net/1885/57967

Collections

ANU Research Publications

Source

Australian Journal of Chemistry

Type

Journal article

DOI

10.1071/CH09269

Restricted until

2037-12-31

Downloads

File

Description

01_Lin_How_Well_Can_Theory_Predict_2009.pdf (203.14 KB)