{"id":5475,"date":"2013-05-16T09:02:24","date_gmt":"2013-05-16T07:02:24","guid":{"rendered":"http:\/\/10.128.3.28\/?p=5475"},"modified":"2025-01-23T10:26:16","modified_gmt":"2025-01-23T09:26:16","slug":"permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos","status":"publish","type":"post","link":"https:\/\/computaex.es\/en\/supercomputacion\/permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos\/","title":{"rendered":"LUSITANIA permite estudiar la tautomer\u00eda imina-enamina mediante m\u00e9todos espectrosc\u00f3picos"},"content":{"rendered":"<p>Varias bases de Schiff derivadas de naftaldeh\u00eddos y anilinas han sido preparadas con objeto de estudiar su tautomer\u00eda imina-enamina mediante m\u00e9todos espectrosc\u00f3picos, cristalogr\u00e1ficos y computacionales. Empleando parte de la potencia de c\u00e1lculo del\u00a0<a class=\"views-ajax-processed-processed\" title=\"Supercomputador LUSITANIA\" href=\"\/en\/cenits\/lusitania\/\">supercomputador LUSITANIA<\/a>, investigadores del grupo\u00a0<a class=\"views-ajax-processed-processed\" href=\"\/en\/proyectos\/quorex\/\">QUOREX<\/a>\u00a0de\u00a0<strong>Qu\u00edmica Org\u00e1nica<\/strong>\u00a0of the\u00a0<a class=\"views-ajax-processed-processed\" title=\"Universidad de Extremadura\" href=\"http:\/\/www.unex.es\/\">Universidad de Extremadura<\/a>\u00a0han podido comprobar que, en disoluci\u00f3n, las formas im\u00ednicas son ligeramente m\u00e1s estables que las enam\u00ednicas, en total concordancia con los resultados obtenidos experimentalmente a trav\u00e9s de resonancia magn\u00e9tica nuclear.<\/p>\n<p>Adem\u00e1s, se ha desarrollado un costoso procedimiento computacional que ha permitido simular el ret\u00edculo cristalino de uno de los derivados sintetizados. A trav\u00e9s de esta simulaci\u00f3n se ha justificado la mayor estabilidad de las formas im\u00ednicas, tal y como se observa en estado s\u00f3lido mediante difracci\u00f3n de rayos X de monocristal.<\/p>\n<p>Estas investigaciones han dado lugar a una nueva publicaci\u00f3n de impacto internacional del\u00a0<a class=\"views-ajax-processed-processed\" title=\"Grupo de investigaci\u00f3n QUOREX\" href=\"\/en\/proyectos\/quorex\/\">grupo de investigaci\u00f3n QUOREX<\/a>\u00a0titulada \u00ab<strong>Tautomerism in Schiff bases. The cases of 2-hydroxy-1-naphthaldehyde and 1-hydroxy-2-naphthaldehyde investigated in solution and the solid state<\/strong>\u00bb en la prestigiosa revista\u00a0<a class=\"views-ajax-processed-processed\" title=\"Organic &amp; Biomolecular Chemistry\" href=\"http:\/\/\/en\/pubs.rsc.org\/en\/journals\/journalissues\/ob\/\">Organic &amp; Biomolecular Chemistry<\/a>\u00a0of the\u00a0<a class=\"views-ajax-processed-processed\" title=\"Royal Society of Chemistry\" href=\"http:\/\/\/en\/pubs.rsc.org\/\">Royal Society of Chemistry<\/a>.<\/p>\n<p>Para acceder a la publicaci\u00f3n:<\/p>\n<ul>\n<li><a class=\"views-ajax-processed-processed\" title=\"Tautomerism in Schiff bases. The cases of 2-hydroxy-1-naphthaldehyde and 1-hydroxy-2-naphthaldehyde investigated in solution and the solid state\" href=\"\/en\/enlaces\/publicaciones\/tautomerism-schiff-bases-cases-2-hydroxy-1-naphthaldehyde-and-1-hydroxy-2-naph\/\">Tautomerism in Schiff bases. The cases of 2-hydroxy-1-naphthaldehyde and 1-hydroxy-2-naphthaldehyde investigated in solution and the solid state<\/a><\/li>\n<\/ul>\n<p>Enlaces de inter\u00e9s:<\/p>\n<ul>\n<li><a class=\"views-ajax-processed-processed\" title=\"Grupo de investigaci\u00f3n QUOREX\" href=\"\/en\/proyectos\/quorex\/\">Grupo de investigaci\u00f3n QUOREX de Qu\u00edmica Org\u00e1nica<\/a>.<\/li>\n<\/ul>","protected":false},"excerpt":{"rendered":"<p>Varias bases de Schiff derivadas de naftaldeh\u00eddos y anilinas han sido preparadas con objeto de estudiar su tautomer\u00eda imina-enamina mediante m\u00e9todos espectrosc\u00f3picos, cristalogr\u00e1ficos y computacionales. Empleando parte de la potencia &#8230;<\/p>","protected":false},"author":1,"featured_media":5476,"comment_status":"closed","ping_status":"open","sticky":false,"template":"","format":"standard","meta":{"footnotes":""},"categories":[84],"tags":[],"class_list":["post-5475","post","type-post","status-publish","format-standard","has-post-thumbnail","hentry","category-supercomputacion"],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v27.1.1 - https:\/\/yoast.com\/product\/yoast-seo-wordpress\/ -->\n<title>LUSITANIA permite estudiar la tautomer\u00eda imina-enamina mediante m\u00e9todos espectrosc\u00f3picos - Fundaci\u00f3n COMPUTAEX<\/title>\n<meta name=\"robots\" content=\"index, follow, max-snippet:-1, max-image-preview:large, max-video-preview:-1\" \/>\n<link rel=\"canonical\" href=\"https:\/\/computaex.es\/en\/supercomputacion\/permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos\/\" \/>\n<meta property=\"og:locale\" content=\"en_US\" \/>\n<meta property=\"og:type\" content=\"article\" \/>\n<meta property=\"og:title\" content=\"LUSITANIA permite estudiar la tautomer\u00eda imina-enamina mediante m\u00e9todos espectrosc\u00f3picos - Fundaci\u00f3n COMPUTAEX\" \/>\n<meta property=\"og:description\" content=\"Varias bases de Schiff derivadas de naftaldeh\u00eddos y anilinas han sido preparadas con objeto de estudiar su tautomer\u00eda imina-enamina mediante m\u00e9todos espectrosc\u00f3picos, cristalogr\u00e1ficos y computacionales. Empleando parte de la potencia ...\" \/>\n<meta property=\"og:url\" content=\"https:\/\/computaex.es\/en\/supercomputacion\/permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos\/\" \/>\n<meta property=\"og:site_name\" content=\"Fundaci\u00f3n COMPUTAEX\" \/>\n<meta property=\"article:publisher\" content=\"https:\/\/m.facebook.com\/computaex\/\" \/>\n<meta property=\"article:published_time\" content=\"2013-05-16T07:02:24+00:00\" \/>\n<meta property=\"article:modified_time\" content=\"2025-01-23T09:26:16+00:00\" \/>\n<meta property=\"og:image\" content=\"https:\/\/computaex.es\/wp-content\/uploads\/2025\/01\/tautomerism-in-schiff-bases.jpg\" \/>\n\t<meta property=\"og:image:width\" content=\"185\" \/>\n\t<meta property=\"og:image:height\" content=\"78\" \/>\n\t<meta property=\"og:image:type\" content=\"image\/jpeg\" \/>\n<meta name=\"author\" content=\"COMPUTAEX\" \/>\n<meta name=\"twitter:card\" content=\"summary_large_image\" \/>\n<meta name=\"twitter:creator\" content=\"@computaex\" \/>\n<meta name=\"twitter:site\" content=\"@computaex\" \/>\n<meta name=\"twitter:label1\" content=\"Written by\" \/>\n\t<meta name=\"twitter:data1\" content=\"COMPUTAEX\" \/>\n\t<meta name=\"twitter:label2\" content=\"Est. reading time\" \/>\n\t<meta name=\"twitter:data2\" content=\"1 minute\" \/>\n<script type=\"application\/ld+json\" class=\"yoast-schema-graph\">{\"@context\":\"https:\/\/schema.org\",\"@graph\":[{\"@type\":\"Article\",\"@id\":\"https:\/\/computaex.es\/supercomputacion\/permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos\/#article\",\"isPartOf\":{\"@id\":\"https:\/\/computaex.es\/supercomputacion\/permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos\/\"},\"author\":{\"name\":\"COMPUTAEX\",\"@id\":\"https:\/\/computaex.es\/#\/schema\/person\/56c40e6e76e66bddcd36a39cb6d96e54\"},\"headline\":\"LUSITANIA permite estudiar la tautomer\u00eda imina-enamina mediante m\u00e9todos espectrosc\u00f3picos\",\"datePublished\":\"2013-05-16T07:02:24+00:00\",\"dateModified\":\"2025-01-23T09:26:16+00:00\",\"mainEntityOfPage\":{\"@id\":\"https:\/\/computaex.es\/supercomputacion\/permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos\/\"},\"wordCount\":253,\"publisher\":{\"@id\":\"https:\/\/computaex.es\/#organization\"},\"image\":{\"@id\":\"https:\/\/computaex.es\/supercomputacion\/permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos\/#primaryimage\"},\"thumbnailUrl\":\"https:\/\/computaex.es\/wp-content\/uploads\/2025\/01\/tautomerism-in-schiff-bases.jpg\",\"articleSection\":[\"Supercomputaci\u00f3n\"],\"inLanguage\":\"en-US\"},{\"@type\":\"WebPage\",\"@id\":\"https:\/\/computaex.es\/supercomputacion\/permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos\/\",\"url\":\"https:\/\/computaex.es\/supercomputacion\/permite-estudiar-la-tautomeria-imina-enamina-mediante-metodos-espectroscopicos\/\",\"name\":\"LUSITANIA permite estudiar la tautomer\u00eda imina-enamina mediante m\u00e9todos espectrosc\u00f3picos - 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