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Article: Torsional angles in alkenylarenes studied by semiempirical molecular orbital methods

TitleTorsional angles in alkenylarenes studied by semiempirical molecular orbital methods
Authors
Ni, YongSiegel, Jay S.Kearns, David R.
Issue Date1991
Citation
Journal of Physical Chemistry, 1991, v. 95, n. 23, p. 9208-9210 How to Cite?
DOI: http://dx.doi.org/10.1021/j100176a033
AbstractEquilibrium torsional angles and torsional potentials for 1- and 2-vinylnaphthalenes, trans-, cis-, and gem-1-naphthylpropenes, and 2- and 9-vinylanthracenes were calculated by using the MNDO and AMI Hamiltonians. The AMI and MNDO results for the above compounds are compared with experimental Findings in the literature. © 1991 American Chemical Society.
Persistent Identifierhttp://hdl.handle.net/10722/341037
ISSN
0022-3654
ISI Accession Number ID
WOS:A1991GQ45700033

 

DC FieldValueLanguage
dc.contributor.authorNi, Yong-
dc.contributor.authorSiegel, Jay S.-
dc.contributor.authorKearns, David R.-
dc.date.accessioned2024-03-13T08:39:39Z-
dc.date.available2024-03-13T08:39:39Z-
dc.date.issued1991-
dc.identifier.citationJournal of Physical Chemistry, 1991, v. 95, n. 23, p. 9208-9210-
dc.identifier.issn0022-3654-
dc.identifier.urihttp://hdl.handle.net/10722/341037-
dc.description.abstractEquilibrium torsional angles and torsional potentials for 1- and 2-vinylnaphthalenes, trans-, cis-, and gem-1-naphthylpropenes, and 2- and 9-vinylanthracenes were calculated by using the MNDO and AMI Hamiltonians. The AMI and MNDO results for the above compounds are compared with experimental Findings in the literature. © 1991 American Chemical Society.-
dc.languageeng-
dc.relation.ispartofJournal of Physical Chemistry-
dc.titleTorsional angles in alkenylarenes studied by semiempirical molecular orbital methods-
dc.typeArticle-
dc.description.naturelink_to_subscribed_fulltext-
dc.identifier.doi10.1021/j100176a033-
dc.identifier.scopuseid_2-s2.0-0012294632-
dc.identifier.volume95-
dc.identifier.issue23-
dc.identifier.spage9208-
dc.identifier.epage9210-
dc.identifier.isiWOS:A1991GQ45700033-

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