Particle on a Ring Model for Teaching the Origin of the Aromatic Stabilization Energy and the Hückel and Baird Rules
dc.contributor.author
dc.date.accessioned
2022-09-28T07:27:06Z
dc.date.available
2022-09-28T07:27:06Z
dc.date.issued
2022-09-22
dc.identifier.issn
0021-9584
dc.identifier.uri
dc.description.abstract
Simple mathematical models can serve to reveal the essence of experimental phenomena and scientific concepts. The particle in a box (PIB), for example, is widely used in undergraduate programs to teach the quantum mechanical principles behind the UV–vis spectra of conjugated polyenes and polyynes. In this work, the particle on a ring (POR) and the PIB models are used to elucidate the concept of aromaticity in Introductory Chemistry courses. Thus, we explain the origin of the aromatic stabilization energy, Hückel’s rule, and Baird’s rule. Besides applications, the limitations of the POR and PIB models are also discussed
dc.description.sponsorship
The authors thank the Spanish Ministerio de Ciencia e
Innovación for Project PID2020-13711GB-I00, the Generalitat
de Catalunya for Project 2017SGR39
Open Access funding provided thanks to the CRUE-CSIC agreement with ACS
dc.format.mimetype
application/pdf
dc.language.iso
eng
dc.publisher
American Chemical Society (ACS)
dc.relation
PID2020-113711GB-I00
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Reproducció digital del document publicat a: https://doi.org/10.1021/acs.jchemed.2c00523
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Journal of Chemical Education, 2022, vol. 99, núm. 10, p. 3497-3501
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Articles publicats (D-Q)
dc.rights
Attribution 4.0 International
dc.rights.uri
dc.subject
dc.title
Particle on a Ring Model for Teaching the Origin of the Aromatic Stabilization Energy and the Hückel and Baird Rules
dc.type
info:eu-repo/semantics/article
dc.rights.accessRights
info:eu-repo/semantics/openAccess
dc.relation.projectID
info:eu-repo/grantAgreement/AEI/Plan Estatal de Investigación Científica y Técnica y de Innovación 2017-2020/PID2020-113711GB-I00/ES/DISEÑO Y SINTESIS DE FULLERENOS PARA LA CONSTRUCCION DE CELDAS SOLARES HIBRIDAS DE PEROVSKITA Y FULERENOS D ALTO RENDIMIENTO. UN ENFOQUE EXPERIMENTAL Y COMPUTACIONAL SINERGICO/
dc.type.version
info:eu-repo/semantics/publishedVersion
dc.identifier.doi
dc.contributor.funder
dc.type.peerreviewed
peer-reviewed
dc.relation.FundingProgramme
dc.relation.ProjectAcronym
dc.identifier.eissn
1938-1328