A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap model
| Autor(a) principal: | |
|---|---|
| Data de Publicação: | 1998 |
| Outros Autores: | , , , |
| Tipo de documento: | Artigo |
| Idioma: | eng |
| Título da fonte: | Repositório Institucional da UNESP |
| Texto Completo: | http://dx.doi.org/10.1590/S0103-50531998000300007 http://hdl.handle.net/11449/65627 |
Resumo: | We present a theoretical description of ligand field effects in the di-μ-azido- bis[{azido(N,N-diethylethylenediamine)} copper(II)] compound by the Simple Overlap Model. The ligand field Hamiltonian is expressed in terms of irreducible tensor operators for an assumed D3h site symmetry occupied by the copper ion. The ligand field parameters, calculated from the available structural data, indicate that the copper ion is under the influence of a very strong ligand field. The energy of the d-d absorption band is well reproduced phenomenologically by the model. |
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Repositório Institucional da UNESP |
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A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap modelAmine ligandsComplexesCopper(II)Ligand fieldWe present a theoretical description of ligand field effects in the di-μ-azido- bis[{azido(N,N-diethylethylenediamine)} copper(II)] compound by the Simple Overlap Model. The ligand field Hamiltonian is expressed in terms of irreducible tensor operators for an assumed D3h site symmetry occupied by the copper ion. The ligand field parameters, calculated from the available structural data, indicate that the copper ion is under the influence of a very strong ligand field. The energy of the d-d absorption band is well reproduced phenomenologically by the model.Depto. de Química Fundamental CCEN-UFPE Cidade Universitária, 50670-901 Recife - PEInstituto de Química da UNESP, C.P. 355, 14900-800 Araraquara - SPDepto. de Ciências da UNIMAR Universidade de Marília, 17525-902 Marília - SPInstituto de Química da USP, C.P. 26077, 05508-900 São Paulo - SPInstituto de Química da UNESP, C.P. 355, 14900-800 Araraquara - SPUniversidade Federal de Pernambuco (UFPE)Universidade Estadual Paulista (Unesp)Universidade de Marília (UNIMAR)Universidade de São Paulo (USP)Malta, O. L.Mauro, A. E. [UNESP]Mattioli, M. P D [UNESP]Sargentelli, V.Brito, H. F.2014-05-27T11:19:40Z2014-05-27T11:19:40Z1998-12-01info:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/article243-247application/pdfhttp://dx.doi.org/10.1590/S0103-50531998000300007Journal of the Brazilian Chemical Society, v. 9, n. 3, p. 243-247, 1998.0103-5053http://hdl.handle.net/11449/6562710.1590/S0103-50531998000300007S0103-50531998000300007WOS:0000759784000072-s2.0-00323298242-s2.0-0032329824.pdfScopusreponame:Repositório Institucional da UNESPinstname:Universidade Estadual Paulista (UNESP)instacron:UNESPengJournal of the Brazilian Chemical Society1.4440,357info:eu-repo/semantics/openAccess2023-11-27T06:12:34Zoai:repositorio.unesp.br:11449/65627Repositório InstitucionalPUBhttp://repositorio.unesp.br/oai/requestopendoar:29462023-11-27T06:12:34Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP)false |
| dc.title.none.fl_str_mv |
A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap model |
| title |
A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap model |
| spellingShingle |
A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap model Malta, O. L. Amine ligands Complexes Copper(II) Ligand field |
| title_short |
A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap model |
| title_full |
A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap model |
| title_fullStr |
A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap model |
| title_full_unstemmed |
A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap model |
| title_sort |
A description of ligand field effects in the Di-μ-Azido-Bis [{Azido(N,N-diethylethylenediamine)}Copper(II)] compound by the simple overlap model |
| author |
Malta, O. L. |
| author_facet |
Malta, O. L. Mauro, A. E. [UNESP] Mattioli, M. P D [UNESP] Sargentelli, V. Brito, H. F. |
| author_role |
author |
| author2 |
Mauro, A. E. [UNESP] Mattioli, M. P D [UNESP] Sargentelli, V. Brito, H. F. |
| author2_role |
author author author author |
| dc.contributor.none.fl_str_mv |
Universidade Federal de Pernambuco (UFPE) Universidade Estadual Paulista (Unesp) Universidade de Marília (UNIMAR) Universidade de São Paulo (USP) |
| dc.contributor.author.fl_str_mv |
Malta, O. L. Mauro, A. E. [UNESP] Mattioli, M. P D [UNESP] Sargentelli, V. Brito, H. F. |
| dc.subject.por.fl_str_mv |
Amine ligands Complexes Copper(II) Ligand field |
| topic |
Amine ligands Complexes Copper(II) Ligand field |
| description |
We present a theoretical description of ligand field effects in the di-μ-azido- bis[{azido(N,N-diethylethylenediamine)} copper(II)] compound by the Simple Overlap Model. The ligand field Hamiltonian is expressed in terms of irreducible tensor operators for an assumed D3h site symmetry occupied by the copper ion. The ligand field parameters, calculated from the available structural data, indicate that the copper ion is under the influence of a very strong ligand field. The energy of the d-d absorption band is well reproduced phenomenologically by the model. |
| publishDate |
1998 |
| dc.date.none.fl_str_mv |
1998-12-01 2014-05-27T11:19:40Z 2014-05-27T11:19:40Z |
| dc.type.status.fl_str_mv |
info:eu-repo/semantics/publishedVersion |
| dc.type.driver.fl_str_mv |
info:eu-repo/semantics/article |
| format |
article |
| status_str |
publishedVersion |
| dc.identifier.uri.fl_str_mv |
http://dx.doi.org/10.1590/S0103-50531998000300007 Journal of the Brazilian Chemical Society, v. 9, n. 3, p. 243-247, 1998. 0103-5053 http://hdl.handle.net/11449/65627 10.1590/S0103-50531998000300007 S0103-50531998000300007 WOS:000075978400007 2-s2.0-0032329824 2-s2.0-0032329824.pdf |
| url |
http://dx.doi.org/10.1590/S0103-50531998000300007 http://hdl.handle.net/11449/65627 |
| identifier_str_mv |
Journal of the Brazilian Chemical Society, v. 9, n. 3, p. 243-247, 1998. 0103-5053 10.1590/S0103-50531998000300007 S0103-50531998000300007 WOS:000075978400007 2-s2.0-0032329824 2-s2.0-0032329824.pdf |
| dc.language.iso.fl_str_mv |
eng |
| language |
eng |
| dc.relation.none.fl_str_mv |
Journal of the Brazilian Chemical Society 1.444 0,357 |
| dc.rights.driver.fl_str_mv |
info:eu-repo/semantics/openAccess |
| eu_rights_str_mv |
openAccess |
| dc.format.none.fl_str_mv |
243-247 application/pdf |
| dc.source.none.fl_str_mv |
Scopus reponame:Repositório Institucional da UNESP instname:Universidade Estadual Paulista (UNESP) instacron:UNESP |
| instname_str |
Universidade Estadual Paulista (UNESP) |
| instacron_str |
UNESP |
| institution |
UNESP |
| reponame_str |
Repositório Institucional da UNESP |
| collection |
Repositório Institucional da UNESP |
| repository.name.fl_str_mv |
Repositório Institucional da UNESP - Universidade Estadual Paulista (UNESP) |
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1797789831462387712 |