Mostrando 10 resultados de: 115
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Journal of Physical Organic Chemistry(15)
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Highly Active MgP Catalyst for Biodiesel Production and Polyethylene Terephthalate Depolymerization
ArticleAbstract: A highly active heterogeneous catalyst was designed and employed for two relevant transesterificatioPalabras claves:Biodiesel, Depolymerization, Magnesium oxide, Pectin, TransesterificationAutores:Alvaro Gallo-Cordova, Daniela Almeida Streitwieser, Diego Sebastian, Jose R. Mora, Pablo A. GangotenaFuentes:scopusHomogeneous and unimolecular gas-phase thermal decomposition kinetics of methyl benzoylformate: Experimental and theoretical study
ArticleAbstract: The kinetics of the gas-phase thermal decomposition of the α-ketoester methyl benzoylformate was carPalabras claves:DFT calculations, Gas-phase thermal decomposition, Kinetic, mechanism, Methyl benzoylformateAutores:Chuchania G., Córdova-Sintjago T.C., Jose R. Mora, Maldonado A., Monascal Y.Fuentes:googlescopusHomogeneous catalysis on the gas-phase dehydration reaction of tertiary alcohols by hydrogen bromide. Density functional theory calculation
Conference ObjectAbstract: The gas-phase thermal dehydration mechanism of tert-butanol, 2-methyl-2-butanol, 2-methyl-2-pentanolPalabras claves:2-methyl-2-butanol, 2-methyl-2-pentanol and 2,3-dimethyl-2-butanol, DFT calculations, Gas-phase thermal decomposition, HBr catalysis, tert-butanolAutores:Brusco Y., Chuchania G., Córdova-Sintjago T.C., Jose R. Mora, Maldonado A., Rosas F.Fuentes:googlescopusHydrogel for the Controlled Delivery of Bioactive Components from Extracts of Eupatorium glutinosum Lam. Leaves
ArticleAbstract: This research reported a hydrogel loaded with the ethanolic and methanolic extracts of Eupatorium glPalabras claves:anti-hemolytic activity, Antibacterial activity, Antioxidant activity, controlled delivery system, secondary metabolitesAutores:Antonio Machado, Frank Alexis, Jose R. Mora, Lizbeth Zamora-Mendoza, Lola De Lima, Santiago Nelson VispoFuentes:googlescopusElectroPredictor: An Application to Predict Mayr’s Electrophilicity E through Implementation of an Ensemble Model Based on Machine Learning Algorithms
ArticleAbstract: Electrophilicity (E) is one of the most important parameters to understand the reactivity of an orgaPalabras claves:Autores:José Luis Paz, Jose R. Mora, López R.A., Marquez E.A., Martín L. Moreno, Martín Moreno, Sebastian CuestaFuentes:googlescopusEnsemble Models Based on QuBiLS-MAS Features and Shallow Learning for the Prediction of Drug-Induced Liver Toxicity: Improving Deep Learning and Traditional Approaches
ArticleAbstract: Drug-induced liver injury (DILI) is a key safety issue in the drug discovery pipeline and a regulatoPalabras claves:Autores:César R. García-Jacas, Jose R. Mora, Suarez Causado A., Yovani Marrero-PonceFuentes:scopusFast Pyrolysis as a Valorization Mechanism for Banana Rachis and Low-Density Polyethylene Waste
ArticleAbstract: Banana rachis and low-density polyethylene (LDPE) were selected as secondary feedstocks for the studPalabras claves:Fast pyrolysis, Free-fall tube reactor, Low-density polyethylene plastics, Residual biomass, Waste managementAutores:Daniela Almeida Streitwieser, Daniela Oña, Erika Gutierrez, Jose R. Mora, Lorena Bejarano M., Sebastián SalazarFuentes:scopusGas‐phase elimination kinetics of selected aliphatic α,β‐unsaturated aldehydes catalyzed by hydrogen chloride
ArticleAbstract: The gas‐phase elimination of 2‐methyl‐2‐propenal catalyzed by HCl yields propene and CO gas, while EPalabras claves:2‐methyl‐2‐propenal, E‐2‐pentenal, gas‐phase elimination, kinetics, mechanismAutores:Chuchania G., Jose R. Mora, Julio L.L., Maldonado A.Fuentes:googlescopusDegradation of methyl paraoxon in the presence of Mg<sup>2+</sup>-Al <sup>3+</sup> mixed oxides
ArticleAbstract: Al3+-Mg2+ mixed oxides were prepared by coprecipitation and characterized with scanning electron micPalabras claves:Autores:Almerindo G., Bechtold I.H., Fiedler H.D., Jose R. Mora, Nome F., Zimmermann L.M.Fuentes:scopusDensity functional theory and ab initio study on the reaction mechanisms of the homogeneous, unimolecular elimination kinetics of selected 1-chloroalkenes in the gas phase
Conference ObjectAbstract: The mechanisms for the unimolecular elimination kinetics of selected 1-chloroalkenes in the gas phasPalabras claves:1-chloroalkenes, density functional theory, elimination kinetics, G3 and G3MP2 method, mechanismAutores:Berroteran N., Chuchania G., Córdova-Sintjago T.C., Jose R. Mora, Lezama J.Fuentes:googlescopus