Experimental and Theoretical Studies of Redox Reactions of o -Chloranil in Aqueous Solution.

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dc.contributor.authorZare, Hamid
dc.contributor.authorEslami, Marzieh
dc.contributor.authorNamazian, Mansoor
dc.contributor.authorCoote, Michelle
dc.date.accessioned2015-12-10T22:35:52Z
dc.date.issued2009
dc.date.updated2016-02-24T10:42:46Z
dc.description.abstractThe electrochemical reduction of o-chloranil (OCA) in aqueous solution has been studied experimentally and theoretically. The effects of temperature and pH on various thermodynamic parameters were studied by means of cyclic voltammetry. The pH dependence
dc.identifier.issn1520-6106
dc.identifier.urihttp://hdl.handle.net/1885/56452
dc.publisherAmerican Chemical Society
dc.sourceJournal of Physical Chemistry B
dc.subjectKeywords: Aqueous solutions; C-PCM solvation model; CBS-QB3; Chloranil; Effects of temperature; Electrochemical reductions; Experimental determination; Experimental methods; Experimental values; Gibbs energy change; High-level ab initio calculations; PH dependence;
dc.titleExperimental and Theoretical Studies of Redox Reactions of o -Chloranil in Aqueous Solution.
dc.typeJournal article
local.bibliographicCitation.issue23
local.bibliographicCitation.lastpage8085
local.bibliographicCitation.startpage8080
local.contributor.affiliationZare, Hamid, Yazd University
local.contributor.affiliationEslami, Marzieh, Yazd University
local.contributor.affiliationNamazian, Mansoor, College of Physical and Mathematical Sciences, ANU
local.contributor.affiliationCoote, Michelle, College of Physical and Mathematical Sciences, ANU
local.contributor.authoruidNamazian, Mansoor, u4352629
local.contributor.authoruidCoote, Michelle, u4031074
local.description.embargo2037-12-31
local.description.notesImported from ARIES
local.identifier.absfor030799 - Theoretical and Computational Chemistry not elsewhere classified
local.identifier.absfor030399 - Macromolecular and Materials Chemistry not elsewhere classified
local.identifier.absseo970103 - Expanding Knowledge in the Chemical Sciences
local.identifier.ariespublicationu4217927xPUB363
local.identifier.citationvolume113
local.identifier.doi10.1021/jp8105265
local.identifier.scopusID2-s2.0-67649349906
local.identifier.thomsonID000266679200018
local.type.statusPublished Version

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