Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related

For the DA reactions between nitropyrrole derivatives and isoprene, the combination of microwave irradiation and protic ionic liquid, has a notable synergistic effect. DFT calculations suggest that a supplementary energy ranking in the IR region of 1700-1400 cm-1 can favour the structural changes in...

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Detalles Bibliográficos
Autores: Mancini, Pedro Maximo Emilio, Ormachea, Carla, Della Rosa, Claudia Daniela, Kneeteman, Maria Nelida, Suarez, Alejandra Graciela, Domingo, Luis R.
Tipo de recurso: artículo
Estado:Versión publicada
Fecha de publicación:2012
País:Argentina
Institución:Consejo Nacional de Investigaciones Científicas y Técnicas
Repositorio:CONICET Digital (CONICET)
Idioma:inglés
OAI Identifier:oai:ri.conicet.gov.ar:11336/108005
Acceso en línea:http://hdl.handle.net/11336/108005
Access Level:acceso abierto
Palabra clave:DIELS-ALDER
LIQUIDOS IONICOS
https://purl.org/becyt/ford/1.4
https://purl.org/becyt/ford/1
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spelling Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study relatedMancini, Pedro Maximo EmilioOrmachea, CarlaDella Rosa, Claudia DanielaKneeteman, Maria NelidaSuarez, Alejandra GracielaDomingo, Luis R.DIELS-ALDERLIQUIDOS IONICOShttps://purl.org/becyt/ford/1.4https://purl.org/becyt/ford/1For the DA reactions between nitropyrrole derivatives and isoprene, the combination of microwave irradiation and protic ionic liquid, has a notable synergistic effect. DFT calculations suggest that a supplementary energy ranking in the IR region of 1700-1400 cm-1 can favour the structural changes in the reactants to reach the TS.Fil: Mancini, Pedro Maximo Emilio. Universidad Nacional del Litoral. Facultad de Ingeniería Química. Departamento de Química; ArgentinaFil: Ormachea, Carla. Universidad Nacional del Litoral. Facultad de Ingeniería Química. Departamento de Química; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Santa Fe; ArgentinaFil: Della Rosa, Claudia Daniela. Universidad Nacional del Litoral. Facultad de Ingeniería Química. Departamento de Química; ArgentinaFil: Kneeteman, Maria Nelida. Universidad Nacional del Litoral. Facultad de Ingeniería Química. Departamento de Química; Argentina. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Santa Fe; ArgentinaFil: Suarez, Alejandra Graciela. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - Rosario. Instituto de Química Rosario. Universidad Nacional de Rosario. Facultad de Ciencias Bioquímicas y Farmacéuticas. Instituto de Química Rosario; ArgentinaFil: Domingo, Luis R.. Universidad de Valencia; EspañaPergamon-Elsevier Science Ltd2012-11info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionhttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdfapplication/pdfapplication/pdfhttp://hdl.handle.net/11336/108005Mancini, Pedro Maximo Emilio; Ormachea, Carla; Della Rosa, Claudia Daniela; Kneeteman, Maria Nelida; Suarez, Alejandra Graciela; et al.; Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related; Pergamon-Elsevier Science Ltd; Tetrahedron Letters; 53; 48; 11-2012; 6508-65110040-4039CONICET DigitalCONICETenginfo:eu-repo/semantics/altIdentifier/url/https://www.sciencedirect.com/science/article/pii/S0040403912016474info:eu-repo/semantics/altIdentifier/doi/10.1016/j.tetlet.2012.09.071info:eu-repo/semantics/openAccesshttps://creativecommons.org/licenses/by-nc-sa/2.5/ar/reponame:CONICET Digital (CONICET)instname:Consejo Nacional de Investigaciones Científicas y Técnicas2024-05-08T14:19:49Zoai:ri.conicet.gov.ar:11336/108005instacron: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:34982024-05-08 14:19:49.443CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicasfalse
dc.title.none.fl_str_mv Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related
title Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related
spellingShingle Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related
Mancini, Pedro Maximo Emilio
DIELS-ALDER
LIQUIDOS IONICOS
https://purl.org/becyt/ford/1.4
https://purl.org/becyt/ford/1
title_short Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related
title_full Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related
title_fullStr Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related
title_full_unstemmed Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related
title_sort Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related
dc.creator.none.fl_str_mv Mancini, Pedro Maximo Emilio
Ormachea, Carla
Della Rosa, Claudia Daniela
Kneeteman, Maria Nelida
Suarez, Alejandra Graciela
Domingo, Luis R.
author Mancini, Pedro Maximo Emilio
author_facet Mancini, Pedro Maximo Emilio
Ormachea, Carla
Della Rosa, Claudia Daniela
Kneeteman, Maria Nelida
Suarez, Alejandra Graciela
Domingo, Luis R.
author_role author
author2 Ormachea, Carla
Della Rosa, Claudia Daniela
Kneeteman, Maria Nelida
Suarez, Alejandra Graciela
Domingo, Luis R.
author2_role author
author
author
author
author
dc.subject.none.fl_str_mv DIELS-ALDER
LIQUIDOS IONICOS
https://purl.org/becyt/ford/1.4
https://purl.org/becyt/ford/1
topic DIELS-ALDER
LIQUIDOS IONICOS
https://purl.org/becyt/ford/1.4
https://purl.org/becyt/ford/1
description For the DA reactions between nitropyrrole derivatives and isoprene, the combination of microwave irradiation and protic ionic liquid, has a notable synergistic effect. DFT calculations suggest that a supplementary energy ranking in the IR region of 1700-1400 cm-1 can favour the structural changes in the reactants to reach the TS.
publishDate 2012
dc.date.none.fl_str_mv 2012-11
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/11336/108005
Mancini, Pedro Maximo Emilio; Ormachea, Carla; Della Rosa, Claudia Daniela; Kneeteman, Maria Nelida; Suarez, Alejandra Graciela; et al.; Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related; Pergamon-Elsevier Science Ltd; Tetrahedron Letters; 53; 48; 11-2012; 6508-6511
0040-4039
CONICET Digital
CONICET
url http://hdl.handle.net/11336/108005
identifier_str_mv Mancini, Pedro Maximo Emilio; Ormachea, Carla; Della Rosa, Claudia Daniela; Kneeteman, Maria Nelida; Suarez, Alejandra Graciela; et al.; Ionic liquids and microwave irradiation as synergistic combination for polar Diels–Alder reactions using properly substituted heterocycles as dienophiles: A DFT study related; Pergamon-Elsevier Science Ltd; Tetrahedron Letters; 53; 48; 11-2012; 6508-6511
0040-4039
CONICET Digital
CONICET
dc.language.none.fl_str_mv eng
language eng
dc.relation.none.fl_str_mv info:eu-repo/semantics/altIdentifier/url/https://www.sciencedirect.com/science/article/pii/S0040403912016474
info:eu-repo/semantics/altIdentifier/doi/10.1016/j.tetlet.2012.09.071
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
dc.publisher.none.fl_str_mv Pergamon-Elsevier Science Ltd
publisher.none.fl_str_mv Pergamon-Elsevier Science Ltd
dc.source.none.fl_str_mv reponame:CONICET Digital (CONICET)
instname:Consejo Nacional de Investigaciones Científicas y Técnicas
instname_str Consejo Nacional de Investigaciones Científicas y Técnicas
reponame_str CONICET Digital (CONICET)
collection CONICET Digital (CONICET)
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 15.228081

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