Syntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligands

Detalhes bibliográficos
Autor(a) principal: Oliveira, Marcelo Ribeiro Leite
Data de Publicação: 2011
Outros Autores: Franca, Eduardo de Faria, Novais, Celice, Guilardi, Silvana, Machado Jr., Iterlandes, Ellena, Javier, Amim Jr., Jorge, Bellis, Vito Modesto de, Rubinger, Mayura Marques Magalhães
Tipo de documento: Artigo
Idioma: eng
Título da fonte: LOCUS Repositório Institucional da UFV
Texto Completo: https://doi.org/10.1016/j.ica.2011.06.025
http://www.locus.ufv.br/handle/123456789/21554
Resumo: Five new complexes of general formula: [Ni(RSO2NCS2)(dppe)], where R = C6H5 (1), 4-ClC6H4 (2), 4-BrC6H4 (3), 4-IC6H4 (4) and dppe = 1,2-bis(diphenylphosphino)ethane and [Ni(4-IC6H4SO2NCS2)(PPh3)2] (5), where PPh3 = triphenylphosphine, were obtained in crystalline form by the reaction of the appropriate potassium N-R-sulfonyldithiocarbimate K2(RSO2NCS2) and dppe or PPh3 with nickel(II) chloride in ethanol/water. The elemental analyses and the IR, ^1H NMR, ^13C NMR and ^31P NMR spectra are consistent with the formation of the square planar nickel(II) complexes with mixed ligands. All complexes were also characterized by X-ray diffraction techniques and present a distorted cis-NiS2P2 square-planar configuration around the Ni atom. Quantum chemical calculations reproduced the crystallographic structures and are in accord with the spectroscopic data. Rare C–H···Ni intramolecular short contact interactions were observed in the complexes 1–5.
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spelling Oliveira, Marcelo Ribeiro LeiteFranca, Eduardo de FariaNovais, CeliceGuilardi, SilvanaMachado Jr., IterlandesEllena, JavierAmim Jr., JorgeBellis, Vito Modesto deRubinger, Mayura Marques Magalhães2018-08-31T10:29:40Z2018-08-31T10:29:40Z2011-10-0100201693https://doi.org/10.1016/j.ica.2011.06.025http://www.locus.ufv.br/handle/123456789/21554Five new complexes of general formula: [Ni(RSO2NCS2)(dppe)], where R = C6H5 (1), 4-ClC6H4 (2), 4-BrC6H4 (3), 4-IC6H4 (4) and dppe = 1,2-bis(diphenylphosphino)ethane and [Ni(4-IC6H4SO2NCS2)(PPh3)2] (5), where PPh3 = triphenylphosphine, were obtained in crystalline form by the reaction of the appropriate potassium N-R-sulfonyldithiocarbimate K2(RSO2NCS2) and dppe or PPh3 with nickel(II) chloride in ethanol/water. The elemental analyses and the IR, ^1H NMR, ^13C NMR and ^31P NMR spectra are consistent with the formation of the square planar nickel(II) complexes with mixed ligands. All complexes were also characterized by X-ray diffraction techniques and present a distorted cis-NiS2P2 square-planar configuration around the Ni atom. Quantum chemical calculations reproduced the crystallographic structures and are in accord with the spectroscopic data. Rare C–H···Ni intramolecular short contact interactions were observed in the complexes 1–5.engInorganica Chimica Actav. 376, n. 1, p. 238- 244, 1 out. 2011Elsevier B.V.info:eu-repo/semantics/openAccessDithiocarbimatesPhosphinesNickel complexesCrystal structuresSyntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligandsinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/articleapplication/pdfreponame:LOCUS Repositório Institucional da UFVinstname:Universidade Federal de Viçosa (UFV)instacron:UFVORIGINALartigo.pdfartigo.pdftexto completoapplication/pdf687098https://locus.ufv.br//bitstream/123456789/21554/1/artigo.pdf60a5bb729d1802f07302deec949c1cddMD51LICENSElicense.txtlicense.txttext/plain; charset=utf-81748https://locus.ufv.br//bitstream/123456789/21554/2/license.txt8a4605be74aa9ea9d79846c1fba20a33MD52THUMBNAILartigo.pdf.jpgartigo.pdf.jpgIM Thumbnailimage/jpeg5274https://locus.ufv.br//bitstream/123456789/21554/3/artigo.pdf.jpg9cfa3ac2866e29c9eeaff3748b7b0d6cMD53123456789/215542018-08-31 23:00:35.704oai:locus.ufv.br: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Repositório InstitucionalPUBhttps://www.locus.ufv.br/oai/requestfabiojreis@ufv.bropendoar:21452018-09-01T02:00:35LOCUS Repositório Institucional da UFV - Universidade Federal de Viçosa (UFV)false
dc.title.en.fl_str_mv Syntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligands
title Syntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligands
spellingShingle Syntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligands
Oliveira, Marcelo Ribeiro Leite
Dithiocarbimates
Phosphines
Nickel complexes
Crystal structures
title_short Syntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligands
title_full Syntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligands
title_fullStr Syntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligands
title_full_unstemmed Syntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligands
title_sort Syntheses, crystal structure and theoretical investigation of novel heteroleptic complexes of nickel(II) with N-R-sulfonyldithiocarbimate and phosphine ligands
author Oliveira, Marcelo Ribeiro Leite
author_facet Oliveira, Marcelo Ribeiro Leite
Franca, Eduardo de Faria
Novais, Celice
Guilardi, Silvana
Machado Jr., Iterlandes
Ellena, Javier
Amim Jr., Jorge
Bellis, Vito Modesto de
Rubinger, Mayura Marques Magalhães
author_role author
author2 Franca, Eduardo de Faria
Novais, Celice
Guilardi, Silvana
Machado Jr., Iterlandes
Ellena, Javier
Amim Jr., Jorge
Bellis, Vito Modesto de
Rubinger, Mayura Marques Magalhães
author2_role author
author
author
author
author
author
author
author
dc.contributor.author.fl_str_mv Oliveira, Marcelo Ribeiro Leite
Franca, Eduardo de Faria
Novais, Celice
Guilardi, Silvana
Machado Jr., Iterlandes
Ellena, Javier
Amim Jr., Jorge
Bellis, Vito Modesto de
Rubinger, Mayura Marques Magalhães
dc.subject.pt-BR.fl_str_mv Dithiocarbimates
Phosphines
Nickel complexes
Crystal structures
topic Dithiocarbimates
Phosphines
Nickel complexes
Crystal structures
description Five new complexes of general formula: [Ni(RSO2NCS2)(dppe)], where R = C6H5 (1), 4-ClC6H4 (2), 4-BrC6H4 (3), 4-IC6H4 (4) and dppe = 1,2-bis(diphenylphosphino)ethane and [Ni(4-IC6H4SO2NCS2)(PPh3)2] (5), where PPh3 = triphenylphosphine, were obtained in crystalline form by the reaction of the appropriate potassium N-R-sulfonyldithiocarbimate K2(RSO2NCS2) and dppe or PPh3 with nickel(II) chloride in ethanol/water. The elemental analyses and the IR, ^1H NMR, ^13C NMR and ^31P NMR spectra are consistent with the formation of the square planar nickel(II) complexes with mixed ligands. All complexes were also characterized by X-ray diffraction techniques and present a distorted cis-NiS2P2 square-planar configuration around the Ni atom. Quantum chemical calculations reproduced the crystallographic structures and are in accord with the spectroscopic data. Rare C–H···Ni intramolecular short contact interactions were observed in the complexes 1–5.
publishDate 2011
dc.date.issued.fl_str_mv 2011-10-01
dc.date.accessioned.fl_str_mv 2018-08-31T10:29:40Z
dc.date.available.fl_str_mv 2018-08-31T10:29:40Z
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/article
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dc.identifier.uri.fl_str_mv https://doi.org/10.1016/j.ica.2011.06.025
http://www.locus.ufv.br/handle/123456789/21554
dc.identifier.issn.none.fl_str_mv 00201693
identifier_str_mv 00201693
url https://doi.org/10.1016/j.ica.2011.06.025
http://www.locus.ufv.br/handle/123456789/21554
dc.language.iso.fl_str_mv eng
language eng
dc.relation.ispartofseries.pt-BR.fl_str_mv v. 376, n. 1, p. 238- 244, 1 out. 2011
dc.rights.driver.fl_str_mv Elsevier B.V.
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dc.publisher.none.fl_str_mv Inorganica Chimica Acta
publisher.none.fl_str_mv Inorganica Chimica Acta
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