A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry students

Detalhes bibliográficos
Autor(a) principal: Baibich,Ione M.
Data de Publicação: 2012
Outros Autores: Butler,Ian S.
Tipo de documento: Artigo
Idioma: eng
Título da fonte: Química Nova (Online)
Texto Completo: http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422012000700032
Resumo: A simple, four-step method for better introducing undergraduate students to the fundamentals of molecular orbital (MO) theory of the polyatomic molecules H2O, NH3, BH3 and SiH4 using group theory is reported. These molecules serve to illustrate the concept of ligand group orbitals (LGOs) and subsequent construction of MO energy diagrams on the basis of molecular symmetry requirements.
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spelling A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry studentsmolecular orbital theoryligands group orbitalsmolecular symmetryA simple, four-step method for better introducing undergraduate students to the fundamentals of molecular orbital (MO) theory of the polyatomic molecules H2O, NH3, BH3 and SiH4 using group theory is reported. These molecules serve to illustrate the concept of ligand group orbitals (LGOs) and subsequent construction of MO energy diagrams on the basis of molecular symmetry requirements.Sociedade Brasileira de Química2012-01-01info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersiontext/htmlhttp://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422012000700032Química Nova v.35 n.7 2012reponame:Química Nova (Online)instname:Sociedade Brasileira de Química (SBQ)instacron:SBQ10.1590/S0100-40422012000700032info:eu-repo/semantics/openAccessBaibich,Ione M.Butler,Ian S.eng2012-08-16T00:00:00Zoai:scielo:S0100-40422012000700032Revistahttps://www.scielo.br/j/qn/ONGhttps://old.scielo.br/oai/scielo-oai.phpquimicanova@sbq.org.br1678-70640100-4042opendoar:2012-08-16T00:00Química Nova (Online) - Sociedade Brasileira de Química (SBQ)false
dc.title.none.fl_str_mv A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry students
title A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry students
spellingShingle A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry students
Baibich,Ione M.
molecular orbital theory
ligands group orbitals
molecular symmetry
title_short A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry students
title_full A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry students
title_fullStr A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry students
title_full_unstemmed A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry students
title_sort A brief introduction to molecular orbital theory of simple polyatomic molecules for undergraduate chemistry students
author Baibich,Ione M.
author_facet Baibich,Ione M.
Butler,Ian S.
author_role author
author2 Butler,Ian S.
author2_role author
dc.contributor.author.fl_str_mv Baibich,Ione M.
Butler,Ian S.
dc.subject.por.fl_str_mv molecular orbital theory
ligands group orbitals
molecular symmetry
topic molecular orbital theory
ligands group orbitals
molecular symmetry
description A simple, four-step method for better introducing undergraduate students to the fundamentals of molecular orbital (MO) theory of the polyatomic molecules H2O, NH3, BH3 and SiH4 using group theory is reported. These molecules serve to illustrate the concept of ligand group orbitals (LGOs) and subsequent construction of MO energy diagrams on the basis of molecular symmetry requirements.
publishDate 2012
dc.date.none.fl_str_mv 2012-01-01
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
format article
status_str publishedVersion
dc.identifier.uri.fl_str_mv http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422012000700032
url http://old.scielo.br/scielo.php?script=sci_arttext&pid=S0100-40422012000700032
dc.language.iso.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv 10.1590/S0100-40422012000700032
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv text/html
dc.publisher.none.fl_str_mv Sociedade Brasileira de Química
publisher.none.fl_str_mv Sociedade Brasileira de Química
dc.source.none.fl_str_mv Química Nova v.35 n.7 2012
reponame:Química Nova (Online)
instname:Sociedade Brasileira de Química (SBQ)
instacron:SBQ
instname_str Sociedade Brasileira de Química (SBQ)
instacron_str SBQ
institution SBQ
reponame_str Química Nova (Online)
collection Química Nova (Online)
repository.name.fl_str_mv Química Nova (Online) - Sociedade Brasileira de Química (SBQ)
repository.mail.fl_str_mv quimicanova@sbq.org.br
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