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Analysis of methyl ester suffocation using density functional theory at b3 lyp/6-31g(d) level

dc.contributorCOLCIENCIAS (Departamento Administrativo de Ciencia, Tecnología e Innovación)es-ES
dc.creatorTorres Ortega, Jesús Alfonso
dc.creatorMorales Medina, Giovanni
dc.creatorSánchez Castellanos, José
dc.date2009-08-14
dc.date.accessioned2019-11-08T21:23:46Z
dc.date.available2019-11-08T21:23:46Z
dc.identifierhttp://hemeroteca.unad.edu.co/index.php/publicaciones-e-investigacion/article/view/566
dc.identifier10.22490/25394088.566
dc.identifier.urihttps://repository.unad.edu.co/handle/10596/29763
dc.descriptionA mechanism for the sulfonation of methyl esters with sulfur trioxide is proposed herein. Reactions were studied in a falling film reactor and stability of the intermediate species verified by Density Functional Theory calculations at the B3LYP/6-31G(d) level. Mechanistic suppositions and experimental facts asserted a second order kinetic.  es-ES
dc.formatapplication/pdf
dc.languagespa
dc.publisherUniversidad Nacional Abierta y a Distancia, UNADes-ES
dc.relationhttp://hemeroteca.unad.edu.co/index.php/publicaciones-e-investigacion/article/view/566/1319
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dc.rightsCopyright (c) 2009 Publicaciones e Investigaciónes-ES
dc.rightshttp://creativecommons.org/licenses/by-sa/4.0es-ES
dc.sourceMagazine specialized in Engineering; Vol. 3 (2009); 29-35en-US
dc.sourcePublicaciones e Investigación; Vol. 3 (2009); 29-35es-ES
dc.source2539-4088
dc.source1900-6608
dc.subjectsulfonation; sulfur trioxide; methyl ester; modeling; density functional.es-ES
dc.subjectSIN INFORMACIONes-ES
dc.titleAnalysis of methyl ester suffocation using density functional theory at b3 lyp/6-31g(d) leveles-ES
dc.typeinfo:eu-repo/semantics/article
dc.typeinfo:eu-repo/semantics/publishedVersion
dc.typeSIN INFORMACIONes-ES
dc.coverageSIN INFORMACIONes-ES
dc.coverageSIN INFORMACIONes-ES
dc.coverageSIN INFORMACIONes-ES


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