Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands

Autores
Tamayo, Isabel Cristina; Casabó, Jaume; Escriche, Lluís; González, Pablo Javier; Lodeiro, Carlos; Rizzi, Alberto Claudio; Brondino, Carlos Dante; Passeggi, Mario Cesar Genaro; Kivekäs, Raikko; Sillanpää, Reijo
Año de publicación
2007
Idioma
inglés
Tipo de recurso
artículo
Estado
versión publicada
Descripción
The properties of Cu(II) and Co(II) complexes with oxygen- or nitrogen-containing macrocycles have been extensively studied; however, less attention has been paid to the study of complexes containing sulfur atoms in the first coordination sphere. Herein we present the interaction between these two metal ions and two macrocyclic ligands with N2S2 donor sets. Cu(II) and Co(II) complexes with the pyridine-containing 14-membered macrocycles 3,11-dithia-7,17-diazabicyclo[11.3.1]heptadeca-1(17), 13,15-triene (L) and 7-(9-anthracenylmethyl)-3,11-dithia-7,17-diazabicycio[11.3.1]heptadeca- 1(17),13,15-triene (L1) have been synthesized. The X-ray structural analysis of {[Co(ClO4)(H2O)(L)][Co(H2O)2(L)]} (ClO4)3 shows two different metal sites in octahedral coordination. The EPR spectra of powdered samples of this compound are typical of distorted six-coordinated Co(II) ions in a high-spin (S = 3/2) configuration, with the ground state being S = 1/2 (g1 = 5.20, g2 = 3.20, g3 = 1.95). The EPR spectrum of [Cu(ClO4)(L)] (ClO4) was simulated assuming an axial g tensor (g1 = g2 = 2.043, g3 = 2.145), while that of [Cu(ClO 4)(L1)](ClO4) slightly differs from an axial symmetry (g1 = 2.025, g2 = 2.060, g3 = 2.155). These results are compatible with a Cu(II) ion in square-pyramidal coordination with N2S2 as basal ligands. Single-crystal EPR experiment performed on [Cu(ClO4)(L1)](ClO4) allowed determining the eigenvalues of the molecular g tensor associated with the copper site, as well as the two possible orientations for the tensor. On the basis of symmetry arguments, an assignment in which the eigenvectors are nearly along the Cu(II)-ligand bonds is chosen.
Fil: Tamayo, Isabel Cristina. Faculdade de Ciências E Tecnologia, Universidade Nova de Lisboa; Portugal. Universitat Autònoma de Barcelona; España
Fil: Casabó, Jaume. Universitat Autònoma de Barcelona; España
Fil: Escriche, Lluís. Universitat Autònoma de Barcelona; España
Fil: González, Pablo Javier. Universidad Nacional del Litoral; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina
Fil: Lodeiro, Carlos. Faculdade de Ciências E Tecnologia, Universidade Nova de Lisboa; Portugal
Fil: Rizzi, Alberto Claudio. Universidad Nacional del Litoral; Argentina
Fil: Brondino, Carlos Dante. Universidad Nacional del Litoral; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina
Fil: Passeggi, Mario Cesar Genaro. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Santa Fe. Instituto de Desarrollo Tecnológico para la Industria Química. Universidad Nacional del Litoral. Instituto de Desarrollo Tecnológico para la Industria Química; Argentina
Fil: Kivekäs, Raikko. Helsingin Yliopisto;
Fil: Sillanpää, Reijo. Universidad de Jyvaskyla; Finlandia
Materia
EPR
Cu(II) and Co(II)
complexes
Nivel de accesibilidad
acceso abierto
Condiciones de uso
https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
Repositorio
CONICET Digital (CONICET)
Institución
Consejo Nacional de Investigaciones Científicas y Técnicas
OAI Identificador
oai:ri.conicet.gov.ar:11336/114113
Acceder
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oai_identifier_str oai:ri.conicet.gov.ar:11336/114113
network_acronym_str CONICETDig
repository_id_str 3498
network_name_str CONICET Digital (CONICET)
spelling Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic LigandsTamayo, Isabel CristinaCasabó, JaumeEscriche, LluísGonzález, Pablo JavierLodeiro, CarlosRizzi, Alberto ClaudioBrondino, Carlos DantePasseggi, Mario Cesar GenaroKivekäs, RaikkoSillanpää, ReijoEPRCu(II) and Co(II)complexeshttps://purl.org/becyt/ford/1.4https://purl.org/becyt/ford/1The properties of Cu(II) and Co(II) complexes with oxygen- or nitrogen-containing macrocycles have been extensively studied; however, less attention has been paid to the study of complexes containing sulfur atoms in the first coordination sphere. Herein we present the interaction between these two metal ions and two macrocyclic ligands with N2S2 donor sets. Cu(II) and Co(II) complexes with the pyridine-containing 14-membered macrocycles 3,11-dithia-7,17-diazabicyclo[11.3.1]heptadeca-1(17), 13,15-triene (L) and 7-(9-anthracenylmethyl)-3,11-dithia-7,17-diazabicycio[11.3.1]heptadeca- 1(17),13,15-triene (L1) have been synthesized. The X-ray structural analysis of {[Co(ClO4)(H2O)(L)][Co(H2O)2(L)]} (ClO4)3 shows two different metal sites in octahedral coordination. The EPR spectra of powdered samples of this compound are typical of distorted six-coordinated Co(II) ions in a high-spin (S = 3/2) configuration, with the ground state being S = 1/2 (g1 = 5.20, g2 = 3.20, g3 = 1.95). The EPR spectrum of [Cu(ClO4)(L)] (ClO4) was simulated assuming an axial g tensor (g1 = g2 = 2.043, g3 = 2.145), while that of [Cu(ClO 4)(L1)](ClO4) slightly differs from an axial symmetry (g1 = 2.025, g2 = 2.060, g3 = 2.155). These results are compatible with a Cu(II) ion in square-pyramidal coordination with N2S2 as basal ligands. Single-crystal EPR experiment performed on [Cu(ClO4)(L1)](ClO4) allowed determining the eigenvalues of the molecular g tensor associated with the copper site, as well as the two possible orientations for the tensor. On the basis of symmetry arguments, an assignment in which the eigenvectors are nearly along the Cu(II)-ligand bonds is chosen.Fil: Tamayo, Isabel Cristina. Faculdade de Ciências E Tecnologia, Universidade Nova de Lisboa; Portugal. Universitat Autònoma de Barcelona; EspañaFil: Casabó, Jaume. Universitat Autònoma de Barcelona; EspañaFil: Escriche, Lluís. Universitat Autònoma de Barcelona; EspañaFil: González, Pablo Javier. Universidad Nacional del Litoral; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas; ArgentinaFil: Lodeiro, Carlos. Faculdade de Ciências E Tecnologia, Universidade Nova de Lisboa; PortugalFil: Rizzi, Alberto Claudio. Universidad Nacional del Litoral; ArgentinaFil: Brondino, Carlos Dante. Universidad Nacional del Litoral; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas; ArgentinaFil: Passeggi, Mario Cesar Genaro. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Santa Fe. Instituto de Desarrollo Tecnológico para la Industria Química. Universidad Nacional del Litoral. Instituto de Desarrollo Tecnológico para la Industria Química; ArgentinaFil: Kivekäs, Raikko. Helsingin Yliopisto;Fil: Sillanpää, Reijo. Universidad de Jyvaskyla; FinlandiaAmerican Chemical Society2007-12info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionhttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdfapplication/pdfapplication/pdfapplication/pdfapplication/pdfhttp://hdl.handle.net/11336/114113Tamayo, Isabel Cristina; Casabó, Jaume; Escriche, Lluís; González, Pablo Javier; Lodeiro, Carlos; et al.; Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands; American Chemical Society; Inorganic Chemistry; 46; 14; 12-2007; 5665-56720020-1669CONICET DigitalCONICETenginfo:eu-repo/semantics/altIdentifier/url/http://pubs.acs.org/doi/abs/10.1021/ic700375d?prevSearch=%255Bauthor%253A%2Babel%2Btamayo%255D&searchHistoryKey=info:eu-repo/semantics/altIdentifier/doi/10.1021/ic700375dinfo:eu-repo/semantics/openAccesshttps://creativecommons.org/licenses/by-nc-sa/2.5/ar/reponame:CONICET Digital (CONICET)instname:Consejo Nacional de Investigaciones Científicas y Técnicas2025-09-03T09:49:58Zoai:ri.conicet.gov.ar:11336/114113instacron:CONICETInstitucionalhttp://ri.conicet.gov.ar/Organismo científico-tecnológicoNo correspondehttp://ri.conicet.gov.ar/oai/requestdasensio@conicet.gov.ar; lcarlino@conicet.gov.arArgentinaNo correspondeNo correspondeNo correspondeopendoar:34982025-09-03 09:49:58.764CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicasfalse
dc.title.none.fl_str_mv Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands
title Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands
spellingShingle Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands
Tamayo, Isabel Cristina
EPR
Cu(II) and Co(II)
complexes
title_short Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands
title_full Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands
title_fullStr Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands
title_full_unstemmed Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands
title_sort Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands
dc.creator.none.fl_str_mv Tamayo, Isabel Cristina
Casabó, Jaume
Escriche, Lluís
González, Pablo Javier
Lodeiro, Carlos
Rizzi, Alberto Claudio
Brondino, Carlos Dante
Passeggi, Mario Cesar Genaro
Kivekäs, Raikko
Sillanpää, Reijo
author Tamayo, Isabel Cristina
author_facet Tamayo, Isabel Cristina
Casabó, Jaume
Escriche, Lluís
González, Pablo Javier
Lodeiro, Carlos
Rizzi, Alberto Claudio
Brondino, Carlos Dante
Passeggi, Mario Cesar Genaro
Kivekäs, Raikko
Sillanpää, Reijo
author_role author
author2 Casabó, Jaume
Escriche, Lluís
González, Pablo Javier
Lodeiro, Carlos
Rizzi, Alberto Claudio
Brondino, Carlos Dante
Passeggi, Mario Cesar Genaro
Kivekäs, Raikko
Sillanpää, Reijo
author2_role author
author
author
author
author
author
author
author
author
dc.subject.none.fl_str_mv EPR
Cu(II) and Co(II)
complexes
topic EPR
Cu(II) and Co(II)
complexes
purl_subject.fl_str_mv https://purl.org/becyt/ford/1.4
https://purl.org/becyt/ford/1
dc.description.none.fl_txt_mv The properties of Cu(II) and Co(II) complexes with oxygen- or nitrogen-containing macrocycles have been extensively studied; however, less attention has been paid to the study of complexes containing sulfur atoms in the first coordination sphere. Herein we present the interaction between these two metal ions and two macrocyclic ligands with N2S2 donor sets. Cu(II) and Co(II) complexes with the pyridine-containing 14-membered macrocycles 3,11-dithia-7,17-diazabicyclo[11.3.1]heptadeca-1(17), 13,15-triene (L) and 7-(9-anthracenylmethyl)-3,11-dithia-7,17-diazabicycio[11.3.1]heptadeca- 1(17),13,15-triene (L1) have been synthesized. The X-ray structural analysis of {[Co(ClO4)(H2O)(L)][Co(H2O)2(L)]} (ClO4)3 shows two different metal sites in octahedral coordination. The EPR spectra of powdered samples of this compound are typical of distorted six-coordinated Co(II) ions in a high-spin (S = 3/2) configuration, with the ground state being S = 1/2 (g1 = 5.20, g2 = 3.20, g3 = 1.95). The EPR spectrum of [Cu(ClO4)(L)] (ClO4) was simulated assuming an axial g tensor (g1 = g2 = 2.043, g3 = 2.145), while that of [Cu(ClO 4)(L1)](ClO4) slightly differs from an axial symmetry (g1 = 2.025, g2 = 2.060, g3 = 2.155). These results are compatible with a Cu(II) ion in square-pyramidal coordination with N2S2 as basal ligands. Single-crystal EPR experiment performed on [Cu(ClO4)(L1)](ClO4) allowed determining the eigenvalues of the molecular g tensor associated with the copper site, as well as the two possible orientations for the tensor. On the basis of symmetry arguments, an assignment in which the eigenvectors are nearly along the Cu(II)-ligand bonds is chosen.
Fil: Tamayo, Isabel Cristina. Faculdade de Ciências E Tecnologia, Universidade Nova de Lisboa; Portugal. Universitat Autònoma de Barcelona; España
Fil: Casabó, Jaume. Universitat Autònoma de Barcelona; España
Fil: Escriche, Lluís. Universitat Autònoma de Barcelona; España
Fil: González, Pablo Javier. Universidad Nacional del Litoral; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina
Fil: Lodeiro, Carlos. Faculdade de Ciências E Tecnologia, Universidade Nova de Lisboa; Portugal
Fil: Rizzi, Alberto Claudio. Universidad Nacional del Litoral; Argentina
Fil: Brondino, Carlos Dante. Universidad Nacional del Litoral; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas; Argentina
Fil: Passeggi, Mario Cesar Genaro. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Santa Fe. Instituto de Desarrollo Tecnológico para la Industria Química. Universidad Nacional del Litoral. Instituto de Desarrollo Tecnológico para la Industria Química; Argentina
Fil: Kivekäs, Raikko. Helsingin Yliopisto;
Fil: Sillanpää, Reijo. Universidad de Jyvaskyla; Finlandia
description The properties of Cu(II) and Co(II) complexes with oxygen- or nitrogen-containing macrocycles have been extensively studied; however, less attention has been paid to the study of complexes containing sulfur atoms in the first coordination sphere. Herein we present the interaction between these two metal ions and two macrocyclic ligands with N2S2 donor sets. Cu(II) and Co(II) complexes with the pyridine-containing 14-membered macrocycles 3,11-dithia-7,17-diazabicyclo[11.3.1]heptadeca-1(17), 13,15-triene (L) and 7-(9-anthracenylmethyl)-3,11-dithia-7,17-diazabicycio[11.3.1]heptadeca- 1(17),13,15-triene (L1) have been synthesized. The X-ray structural analysis of {[Co(ClO4)(H2O)(L)][Co(H2O)2(L)]} (ClO4)3 shows two different metal sites in octahedral coordination. The EPR spectra of powdered samples of this compound are typical of distorted six-coordinated Co(II) ions in a high-spin (S = 3/2) configuration, with the ground state being S = 1/2 (g1 = 5.20, g2 = 3.20, g3 = 1.95). The EPR spectrum of [Cu(ClO4)(L)] (ClO4) was simulated assuming an axial g tensor (g1 = g2 = 2.043, g3 = 2.145), while that of [Cu(ClO 4)(L1)](ClO4) slightly differs from an axial symmetry (g1 = 2.025, g2 = 2.060, g3 = 2.155). These results are compatible with a Cu(II) ion in square-pyramidal coordination with N2S2 as basal ligands. Single-crystal EPR experiment performed on [Cu(ClO4)(L1)](ClO4) allowed determining the eigenvalues of the molecular g tensor associated with the copper site, as well as the two possible orientations for the tensor. On the basis of symmetry arguments, an assignment in which the eigenvectors are nearly along the Cu(II)-ligand bonds is chosen.
publishDate 2007
dc.date.none.fl_str_mv 2007-12
dc.type.none.fl_str_mv info:eu-repo/semantics/article
info:eu-repo/semantics/publishedVersion
http://purl.org/coar/resource_type/c_6501
info:ar-repo/semantics/articulo
format article
status_str publishedVersion
dc.identifier.none.fl_str_mv http://hdl.handle.net/11336/114113
Tamayo, Isabel Cristina; Casabó, Jaume; Escriche, Lluís; González, Pablo Javier; Lodeiro, Carlos; et al.; Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands; American Chemical Society; Inorganic Chemistry; 46; 14; 12-2007; 5665-5672
0020-1669
CONICET Digital
CONICET
url http://hdl.handle.net/11336/114113
identifier_str_mv Tamayo, Isabel Cristina; Casabó, Jaume; Escriche, Lluís; González, Pablo Javier; Lodeiro, Carlos; et al.; Structural and EPR Studies on Single-Crystal and Polycrystalline Samples of Copper(II) and Cobalt(II) Complexes with N2S2-Based Macrocyclic Ligands; American Chemical Society; Inorganic Chemistry; 46; 14; 12-2007; 5665-5672
0020-1669
CONICET Digital
CONICET
dc.language.none.fl_str_mv eng
language eng
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info:eu-repo/semantics/altIdentifier/doi/10.1021/ic700375d
dc.rights.none.fl_str_mv info:eu-repo/semantics/openAccess
https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
eu_rights_str_mv openAccess
rights_invalid_str_mv https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
dc.format.none.fl_str_mv application/pdf
application/pdf
application/pdf
application/pdf
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dc.publisher.none.fl_str_mv American Chemical Society
publisher.none.fl_str_mv American Chemical Society
dc.source.none.fl_str_mv reponame:CONICET Digital (CONICET)
instname:Consejo Nacional de Investigaciones Científicas y Técnicas
reponame_str CONICET Digital (CONICET)
collection CONICET Digital (CONICET)
instname_str Consejo Nacional de Investigaciones Científicas y Técnicas
repository.name.fl_str_mv CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicas
repository.mail.fl_str_mv dasensio@conicet.gov.ar; lcarlino@conicet.gov.ar
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score 13.13397

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