Browsing by Author "77b46660-fde0-49c0-81f5-4cb506687093"
Now showing items 1-6 of 6
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Vallejos, Gabriel; Caroli Rezende, Marcos; Cassels Niven, Bruce (Kluwer Academic Publishers, 2002-03-05)The HOMO energies and the charges on the aromatic carbons of two sets of MAO-A-inhibiting phenylisopropylamines, one containing 4-amino substituents, were calculated by the AM1 method, in order to evaluate the importance ...
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Vilches-Herrera, Marcelo; Concha-Puelles, Matias; Carvajal, Nicole; Molina, Juana; Santander, Rocio; Caroli Rezende, Marcos; Lühr, Susan (Elsevier B.V., 2018)© 2018 Elsevier B.V. The correlation between the activity, regio- and chemoselectivity of Rh-diphosphine catalyst and the ligand bite natural angle (βn) in the syngas-free hydroformylation of allyl cyanide was investigated. ...
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Osorio Olivares, Mauricio; Caroli Rezende, Marcos; Sepúlveda Boza, Silvia; Cassels Niven, Bruce; Fierro, Angélica (Elsevier Ltd., 2004-05-26)Abstract—Twenty-nine arylisopropylamines, substituted at the b-position of their side chain by an oxo, hydroxy, or methoxy group, were evaluated in vitro as MAO-A and MAO-B inhibitors. The oxo derivatives (‘cathinones’) ...
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Mechanism of fluorophore quenching in a pre-fluorescent nitroxide probe: A theoretical illustration Aliaga, Carolina; Fuentealba Rosas, Patricio; Caroli Rezende, Marcos; Cárdenas Valencia, Carlos (Elsevier, 2014)The mechanism of fluorophore quenching in QT, a pre-fluorescent quinoline-TEMPO probe, is illustrated with the aid of a molecular-orbital analysis, offering a pictorial view of the process that takes place in the excited ...
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Almodovar, Iriux; Cardona, Wilson; Delgado Castro, Tomás; Zapata Torres, Gerald; Caroli Rezende, Marcos; Araya Maturana, Ramiro; Maestro, M. Carmen; García Ruano, José L. (2013)Diels-Alder cycloaddition of 8,8-dimethylnaphthalene-1,4,5(8H)-trione with diastereomeric hydroxysulfinyldienes proceeded with high yields and good π-facial and regioselectivities. The hydroxysulfoxide moiety controls the ...
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Almodovar, Iriux; Caroli Rezende, Marcos; Cassels Niven, Bruce; García Arriagada, Macarena (Wiley, 2017)The mechanism of the cyclization step of the Pictet-Spengler reaction between acetaldehyde and dopamine to give salsolinol and isosalsolinol was studied computationally, using density functional theory. The preferential ...