A Comprehensive Study on the Mechanism of Diallyl Disulfide (All2S2) Thermal Decomposition in the Gas Phase
contributor author | محمد ایزدیار | en |
contributor author | Mohammad Izadyar | fa |
date accessioned | 2020-06-06T14:06:51Z | |
date available | 2020-06-06T14:06:51Z | |
date copyright | 9/3/2012 | |
date issued | 2012 | |
identifier uri | https://libsearch.um.ac.ir:443/fum/handle/fum/3382951?show=full | |
description abstract | A theoretical kinetic and mechanism of diallyl disulfide pyrolysis reaction in the gas phase was studied over the temperature range of 603 K . Theoretical calculations at the B3LYP level using the 6-31G*, 6-31++G** and 6-311++G** basis sets confirm the radical mechanism for the diallyl disulfide pyrolysis. The calculated kinetic and activation parameters especially at the B3LYP/6- 31G* level are in good agreement with the experimental data. | en |
language | English | |
title | A Comprehensive Study on the Mechanism of Diallyl Disulfide (All2S2) Thermal Decomposition in the Gas Phase | en |
type | Conference Paper | |
contenttype | External Fulltext | |
subject keywords | Diallyl disulfide | en |
subject keywords | Gas phase | en |
subject keywords | kinetic | en |
subject keywords | Mechanism | en |
subject keywords | Radical | en |
subject keywords | Concerted | en |
identifier link | https://profdoc.um.ac.ir/paper-abstract-1029505.html | |
conference title | 15Iranian physical chemistry seminar | en |
conference location | Tehran | fa |
identifier articleid | 1029505 |
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