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dc.contributor.author
Khadir, Narjes
dc.contributor.author
Boghaei, Davar M.
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Assoud, Abdeljalil
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Nascimento, Otaciro R.
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Nicotina, Amanda
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Ghivelder, Luis
dc.contributor.author
Calvo, Rafael
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dc.date.available
2016-02-25T17:57:45Z
dc.date.issued
2014-12
dc.identifier.citation
Khadir, Narjes; Boghaei, Davar M.; Assoud, Abdeljalil; Nascimento, Otaciro R.; Nicotina, Amanda; et al.; The structure , magnetism and EPR spectra of a (μ-thiophenolato)(μ-pyrazolato-N,N') double bridged dicopper(II) complex; Royal Society of Chemistry; Dalton Transactions; 44; 5; 12-2014; 2431-2438
dc.identifier.issn
1477-9226
dc.identifier.uri
http://hdl.handle.net/11336/4431
dc.description.abstract
A new binuclear copper(II) complex, namely [Cu2L(pz)(DMSO)], where L = 2,6-bis[(2-phenoxy)iminomethyl]-4-methylthiophenolate(3-) and pz = pyrazolate ligand, has been synthesized by a one-pot synthesis involving copper(II) acetate monohydrate, the S-protected ligand precursor 2-(N,Ndimethylthiocarbamato)-5-methylisophthalaldehyde di-2?-hydroxy anil, (I), and pyrazole, in which a metal-promoted S-deprotection reaction occurs during the formation of the complex. This was characterized by routine physicochemical studies, single crystal X-ray diffraction and electron paramagnetic<br />resonance (EPR) techniques. The structure analysis reveals that there are copper centres in two different environments, a slightly distorted square planar and a distorted square-pyramidal, arranged in binuclear units. The EPR study of these binuclear units performed at 9.4 GHz in the temperature range between 4 and 293 K shows an antiferromagnetic interaction between CuII ions, and allows evaluating g factors gx = 2.068(1), gy = 2.091(1) and gz = 2.165(1), with <g> = 2.108(1), an exchange coupling parameter J0 = -26(1) cm−1 (defined as Hex = - J0 S1 S2), and a zero field splitting of the ground triplet state described by D = 86(2) × 10-4 cm-1 and E = -48(3) × 10-4 cm-1. These results are discussed and compared with the existing literature.
dc.format
application/pdf
dc.language.iso
eng
dc.publisher
Royal Society of Chemistry
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dc.rights
info:eu-repo/semantics/openAccess
dc.rights.uri
https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
dc.subject
Dinuclear Copper
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Tiofenolato
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Pirazolato
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Magnetismo
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Estructura
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Rpe
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Físico-Química, Ciencia de los Polímeros, Electroquímica
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dc.subject.classification
Ciencias Químicas
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CIENCIAS NATURALES Y EXACTAS
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dc.title
The structure , magnetism and EPR spectra of a (μ-thiophenolato)(μ-pyrazolato-N,N') double bridged dicopper(II) complex
dc.type
info:eu-repo/semantics/article
dc.type
info:ar-repo/semantics/artículo
dc.type
info:eu-repo/semantics/publishedVersion
dc.date.updated
2016-03-30 10:35:44.97925-03
dc.journal.volume
44
dc.journal.number
5
dc.journal.pagination
2431-2438
dc.journal.pais
Reino Unido
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dc.journal.ciudad
Cambridge
dc.description.fil
Fil: Khadir, Narjes. Sharif University of Technology. Department of Chemistry; Irán
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Fil: Boghaei, Davar M.. Sharif University of Technology. Department of Chemistry; Irán
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Fil: Assoud, Abdeljalil. University of Waterloo. Department of Chemistry; Canadá
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Fil: Nascimento, Otaciro R.. Universidade de São Paulo. Instituto de Física de São Carlos. Departamento de Física e Ciência Interdisciplinar. Grupo de Biofísica Molecular Sergio Mascarenhas; Brasil
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Fil: Nicotina, Amanda. Universidade Federal do Rio de Janeiro. Instituto de Física; Brasil
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Fil: Ghivelder, Luis. Universidade Federal do Rio de Janeiro. Instituto de Física; Brasil
dc.description.fil
Fil: Calvo, Rafael. Universidad Nacional del Litoral. Facultad de Bioquímica y Ciencias Biológicas. Departamento de Física; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Santa Fe. Instituto de Física del Litoral; Argentina
dc.journal.title
Dalton Transactions
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dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/url/http://pubs.rsc.org/en/content/articlelanding/2014/dt/c4dt03322a
dc.relation.alternativeid
info:eu-repo/semantics/altIdentifier/doi/http://dx.doi.org/DOI:10.1039/C4DT03322A
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