Modelling reaction kinetics of distonic radical ions: a systematic investigation of phenyl-type radical addition to unsaturated hydrocarbons-Reference-Cited by-同舟云学术

Modelling reaction kinetics of distonic radical ions: a systematic investigation of phenyl-type radical addition to unsaturated hydrocarbons

Published:2022 Issue: Volume:238 Page:475-490
ISSN:1359-6640
Container-title:Faraday Discussions
language:en
Short-container-title:Faraday Discuss.

Author:

Shiels Oisin J.¹^ORCID,Turner Jack A.¹^ORCID,Kelly P. D.¹,Blanksby Stephen J.²^ORCID,da Silva Gabriel³^ORCID,Trevitt Adam J.¹^ORCID

Affiliation:

1. Molecular Horizons and School of Chemistry and Molecular Bioscience, University of Wollongong, Australia

2. Central Analytical Research Facility and the School of Chemistry and Physics, Queensland University of Technology, Australia

3. Department of Chemical Engineering, The University of Melbourne, Australia

Abstract

We measure second-order rate coefficients for a suite of radical-ion reactions involving unsaturated hydrocarbons (C2H2 and C2H4), and report our efforts to develop an accurate modelling framework using a Rice–Ramsperger–Kassel–Marcus theory Master Equation approach.

Funder

Australian Research Council

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2022/FD/D2FD00045H

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