Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado

Detalhes bibliográficos
Ano de defesa: 2016
Autor(a) principal: BALDEZ, Thays Silva lattes
Orientador(a): MENEZES, Alan Silva de
Banca de defesa: Não Informado pela instituição
Tipo de documento: Dissertação
Tipo de acesso: Acesso aberto
Idioma: por
Instituição de defesa: Universidade Federal do Maranhão
Programa de Pós-Graduação: PROGRAMA DE PÓS-GRADUAÇÃO EM CIÊNCIA DOS MATERIAIS/CCSST
Departamento: COORDENAÇÃO DO CURSO DE CIENCIA E TECNOLOGIA - IMPERATRIZ/CCSST
País: Brasil
Palavras-chave em Português:
Palavras-chave em Inglês:
Área do conhecimento CNPq:
Link de acesso: http://tedebc.ufma.br:8080/jspui/handle/tede/1344
Resumo: Amino acids complex of transition metals has increasingly attracted the interest of researchers due to their wide range of physical properties for understanding metal-amino acid interactions. In this work [Bis(L-Alaninato)Diaqua] Nickel(II) Dihydrate [Ni(C3H6O2N)2(H2O)2.2H2O] crystals were obtained by slow evaporation method using 0,1 mol/L of NiCl2.6H2O, 0,2 mol/L of L-alanine and NaOH. Rietveld refinement of X-ray data confirmed the structure. The structural properties of these crystals were studied by X-ray diffraction (XRD) in the temperature range from 25 to 150 °C. Thermal analysis experiments were performed by TG/DTA between 25 and 500 °C, and by DSC between 25 and 250 °C. The results obtained by TG/DTA indicate the loss of water molecules by [Bis(L-Alaninato)Diaqua] Nickel(II) Dihydrate crystals at temperatures of 64 and 117 °C, which was also confirmed by the results obtained by DSC. The X-ray diffraction pattern show new peaks, in temperatures around 55 and 110 ° C, indicating to loss of water by crystals. The transformation is irreversible because the diffraction pattern obtained after the sample return to the room temperature differs from that obtained before heating of the sample. The vibrational properties were analyzed by Raman spectroscopy between 25 and 185 °C. The Raman spectroscopy measurements as a function of the temperature show the loss of water molecules. The spectra at high temperatures resemble the spectrum at room temperature, showing that the crystal undergoes phase transformation, but probably do not change the crystal symmetry.
id UFMA_370d4e875f0813afbb40c6e1b6aa7368
oai_identifier_str oai:tede2:tede/1344
network_acronym_str UFMA
network_name_str Biblioteca Digital de Teses e Dissertações da UFMA
repository_id_str
spelling MENEZES, Alan Silva de642.782.713-87SANTOS, Adenilson Oliveira dos016.759.989-57039.574.653-11http://lattes.cnpq.br/8605813851309766BALDEZ, Thays Silva2017-05-05T20:04:11Z2016-07-06BALDEZ, Thays Silva. Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado. 2016. 80 f. Dissertação (Programa de Pós-Graduação em Ciência dos Materiais) - Universidade Federal do Maranhão, Imperatriz, 2016 .http://tedebc.ufma.br:8080/jspui/handle/tede/1344Amino acids complex of transition metals has increasingly attracted the interest of researchers due to their wide range of physical properties for understanding metal-amino acid interactions. In this work [Bis(L-Alaninato)Diaqua] Nickel(II) Dihydrate [Ni(C3H6O2N)2(H2O)2.2H2O] crystals were obtained by slow evaporation method using 0,1 mol/L of NiCl2.6H2O, 0,2 mol/L of L-alanine and NaOH. Rietveld refinement of X-ray data confirmed the structure. The structural properties of these crystals were studied by X-ray diffraction (XRD) in the temperature range from 25 to 150 °C. Thermal analysis experiments were performed by TG/DTA between 25 and 500 °C, and by DSC between 25 and 250 °C. The results obtained by TG/DTA indicate the loss of water molecules by [Bis(L-Alaninato)Diaqua] Nickel(II) Dihydrate crystals at temperatures of 64 and 117 °C, which was also confirmed by the results obtained by DSC. The X-ray diffraction pattern show new peaks, in temperatures around 55 and 110 ° C, indicating to loss of water by crystals. The transformation is irreversible because the diffraction pattern obtained after the sample return to the room temperature differs from that obtained before heating of the sample. The vibrational properties were analyzed by Raman spectroscopy between 25 and 185 °C. The Raman spectroscopy measurements as a function of the temperature show the loss of water molecules. The spectra at high temperatures resemble the spectrum at room temperature, showing that the crystal undergoes phase transformation, but probably do not change the crystal symmetry.Aminoácidos complexados com metais de transição têm atraído cada vez mais o interesse de pesquisadores devido à grande variedade de propriedades físicas que eles apresentam para o entendimento das interações metal-aminoácido. Neste trabalho, cristais de Bis(L-alaninato) de Níquel (II) di-hidratado [Ni(C3H6O2N)2(H2O)2.2H2O] foram obtidos por meio da evaporação lenta do solvente de uma solução saturada contendo 0,1 mol/L de NiCl2.6H2O, 0,2 mol/L de L-alanina e NaOH. Após a obtenção da amostra, a confirmação da estrutura deu-se por refinamento de Rietveld. As propriedades estruturais desses cristais foram estudadas por medidas de difração de raios-X em função da temperatura na faixa de 25 a 150 °C. Experimentos de análise térmica foram realizados por TG/DTA entre 25 e 500 °C e por DSC entre 25 e 250 °C. Os resultados obtidos por TG/DTA evidenciam a saída das moléculas de água do cristal de Bis(L-alaninato) de Níquel (II) di-hidratado nas temperaturas de 64,51 e 117,25 °C, que também foi confirmada pelos resultados obtidos por DSC. O padrão de difração de raios-X mostrou desaparecimento e o surgimento de novos picos no difratograma, para temperaturas próximas a 55 °C e 110 °C, indicando a saída de água do cristal. Essa transformação é irreversível, pois o padrão de difração obtido após a amostra retornar à temperatura ambiente difere significativamente daquele obtido antes do aquecimento. As propriedades vibracionais foram analisadas por Espectroscopia Raman entre 25 e 185 °C. As medidas dos espectros Raman em função da temperatura evidenciam a saída das moléculas de água. O espectro à alta temperatura se assemelha ao espectro à temperatura ambiente, mostrando que o cristal sofre transformação de fase, mas provavelmente permanece com a mesma simetria cristalina.Submitted by Rosivalda Pereira (mrs.pereira@ufma.br) on 2017-05-05T20:04:11Z No. of bitstreams: 1 ThaysSilvaBaldez.pdf: 2095828 bytes, checksum: 9de3dacfb0850842d669bc07ee7407eb (MD5)Made available in DSpace on 2017-05-05T20:04:11Z (GMT). No. of bitstreams: 1 ThaysSilvaBaldez.pdf: 2095828 bytes, checksum: 9de3dacfb0850842d669bc07ee7407eb (MD5) Previous issue date: 2016-07-06Coordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)application/pdfporUniversidade Federal do MaranhãoPROGRAMA DE PÓS-GRADUAÇÃO EM CIÊNCIA DOS MATERIAIS/CCSSTUFMABrasilCOORDENAÇÃO DO CURSO DE CIENCIA E TECNOLOGIA - IMPERATRIZ/CCSSTComplexo de aminoácidoDifração de raios-XEspectroscopia RamanEstabilidade térmicaAmino acid complexX-ray diffractionRaman spectroscopyThermal stabilityFísica da Matéria CondensadaEstudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratadoSTRUCTURAL, THERMAL AND VIBRATIONAL STUDY OF BIS (L-ALANINATE) CRYSTAL OF NICKEL (II) DIHYDRATEinfo:eu-repo/semantics/publishedVersioninfo:eu-repo/semantics/masterThesisinfo:eu-repo/semantics/openAccessreponame:Biblioteca Digital de Teses e Dissertações da UFMAinstname:Universidade Federal do Maranhão (UFMA)instacron:UFMAORIGINALThaysSilvaBaldez.pdfThaysSilvaBaldez.pdfapplication/pdf2095828http://tedebc.ufma.br:8080/bitstream/tede/1344/2/ThaysSilvaBaldez.pdf9de3dacfb0850842d669bc07ee7407ebMD52LICENSElicense.txtlicense.txttext/plain; charset=utf-82255http://tedebc.ufma.br:8080/bitstream/tede/1344/1/license.txt97eeade1fce43278e63fe063657f8083MD51tede/13442023-01-18 14:45:35.366oai:tede2: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Biblioteca Digital de Teses e Dissertaçõeshttps://tedebc.ufma.br/jspui/PUBhttp://tedebc.ufma.br:8080/oai/requestrepositorio@ufma.br||repositorio@ufma.bropendoar:21312023-01-18T17:45:35Biblioteca Digital de Teses e Dissertações da UFMA - Universidade Federal do Maranhão (UFMA)false
dc.title.por.fl_str_mv Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado
dc.title.alternative.por.fl_str_mv STRUCTURAL, THERMAL AND VIBRATIONAL STUDY OF BIS (L-ALANINATE) CRYSTAL OF NICKEL (II) DIHYDRATE
title Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado
spellingShingle Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado
BALDEZ, Thays Silva
Complexo de aminoácido
Difração de raios-X
Espectroscopia Raman
Estabilidade térmica
Amino acid complex
X-ray diffraction
Raman spectroscopy
Thermal stability
Física da Matéria Condensada
title_short Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado
title_full Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado
title_fullStr Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado
title_full_unstemmed Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado
title_sort Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado
author BALDEZ, Thays Silva
author_facet BALDEZ, Thays Silva
author_role author
dc.contributor.advisor1.fl_str_mv MENEZES, Alan Silva de
dc.contributor.advisor1ID.fl_str_mv 642.782.713-87
dc.contributor.advisor-co1.fl_str_mv SANTOS, Adenilson Oliveira dos
dc.contributor.advisor-co1ID.fl_str_mv 016.759.989-57
dc.contributor.authorID.fl_str_mv 039.574.653-11
dc.contributor.authorLattes.fl_str_mv http://lattes.cnpq.br/8605813851309766
dc.contributor.author.fl_str_mv BALDEZ, Thays Silva
contributor_str_mv MENEZES, Alan Silva de
SANTOS, Adenilson Oliveira dos
dc.subject.por.fl_str_mv Complexo de aminoácido
Difração de raios-X
Espectroscopia Raman
Estabilidade térmica
topic Complexo de aminoácido
Difração de raios-X
Espectroscopia Raman
Estabilidade térmica
Amino acid complex
X-ray diffraction
Raman spectroscopy
Thermal stability
Física da Matéria Condensada
dc.subject.eng.fl_str_mv Amino acid complex
X-ray diffraction
Raman spectroscopy
Thermal stability
dc.subject.cnpq.fl_str_mv Física da Matéria Condensada
description Amino acids complex of transition metals has increasingly attracted the interest of researchers due to their wide range of physical properties for understanding metal-amino acid interactions. In this work [Bis(L-Alaninato)Diaqua] Nickel(II) Dihydrate [Ni(C3H6O2N)2(H2O)2.2H2O] crystals were obtained by slow evaporation method using 0,1 mol/L of NiCl2.6H2O, 0,2 mol/L of L-alanine and NaOH. Rietveld refinement of X-ray data confirmed the structure. The structural properties of these crystals were studied by X-ray diffraction (XRD) in the temperature range from 25 to 150 °C. Thermal analysis experiments were performed by TG/DTA between 25 and 500 °C, and by DSC between 25 and 250 °C. The results obtained by TG/DTA indicate the loss of water molecules by [Bis(L-Alaninato)Diaqua] Nickel(II) Dihydrate crystals at temperatures of 64 and 117 °C, which was also confirmed by the results obtained by DSC. The X-ray diffraction pattern show new peaks, in temperatures around 55 and 110 ° C, indicating to loss of water by crystals. The transformation is irreversible because the diffraction pattern obtained after the sample return to the room temperature differs from that obtained before heating of the sample. The vibrational properties were analyzed by Raman spectroscopy between 25 and 185 °C. The Raman spectroscopy measurements as a function of the temperature show the loss of water molecules. The spectra at high temperatures resemble the spectrum at room temperature, showing that the crystal undergoes phase transformation, but probably do not change the crystal symmetry.
publishDate 2016
dc.date.issued.fl_str_mv 2016-07-06
dc.date.accessioned.fl_str_mv 2017-05-05T20:04:11Z
dc.type.status.fl_str_mv info:eu-repo/semantics/publishedVersion
dc.type.driver.fl_str_mv info:eu-repo/semantics/masterThesis
format masterThesis
status_str publishedVersion
dc.identifier.citation.fl_str_mv BALDEZ, Thays Silva. Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado. 2016. 80 f. Dissertação (Programa de Pós-Graduação em Ciência dos Materiais) - Universidade Federal do Maranhão, Imperatriz, 2016 .
dc.identifier.uri.fl_str_mv http://tedebc.ufma.br:8080/jspui/handle/tede/1344
identifier_str_mv BALDEZ, Thays Silva. Estudo estrutural, térmico e vibracional do crista de Bis (L-alaninato) de Níquel (II) di-hidratado. 2016. 80 f. Dissertação (Programa de Pós-Graduação em Ciência dos Materiais) - Universidade Federal do Maranhão, Imperatriz, 2016 .
url http://tedebc.ufma.br:8080/jspui/handle/tede/1344
dc.language.iso.fl_str_mv por
language por
dc.rights.driver.fl_str_mv info:eu-repo/semantics/openAccess
eu_rights_str_mv openAccess
dc.format.none.fl_str_mv application/pdf
dc.publisher.none.fl_str_mv Universidade Federal do Maranhão
dc.publisher.program.fl_str_mv PROGRAMA DE PÓS-GRADUAÇÃO EM CIÊNCIA DOS MATERIAIS/CCSST
dc.publisher.initials.fl_str_mv UFMA
dc.publisher.country.fl_str_mv Brasil
dc.publisher.department.fl_str_mv COORDENAÇÃO DO CURSO DE CIENCIA E TECNOLOGIA - IMPERATRIZ/CCSST
publisher.none.fl_str_mv Universidade Federal do Maranhão
dc.source.none.fl_str_mv reponame:Biblioteca Digital de Teses e Dissertações da UFMA
instname:Universidade Federal do Maranhão (UFMA)
instacron:UFMA
instname_str Universidade Federal do Maranhão (UFMA)
instacron_str UFMA
institution UFMA
reponame_str Biblioteca Digital de Teses e Dissertações da UFMA
collection Biblioteca Digital de Teses e Dissertações da UFMA
bitstream.url.fl_str_mv http://tedebc.ufma.br:8080/bitstream/tede/1344/2/ThaysSilvaBaldez.pdf
http://tedebc.ufma.br:8080/bitstream/tede/1344/1/license.txt
bitstream.checksum.fl_str_mv 9de3dacfb0850842d669bc07ee7407eb
97eeade1fce43278e63fe063657f8083
bitstream.checksumAlgorithm.fl_str_mv MD5
MD5
repository.name.fl_str_mv Biblioteca Digital de Teses e Dissertações da UFMA - Universidade Federal do Maranhão (UFMA)
repository.mail.fl_str_mv repositorio@ufma.br||repositorio@ufma.br
_version_ 1797055605890875392