Recebido em 5/11/99; aceito em 17/1/00 Four commonplace concerted reactions are examined using (i) correlation diagrams, (ii) frontier molecular orbital analyses for transition states, (iii) Zimmerman-Dewar analyses for transition states and (iv) modified Zimmerman-Dewar analyses for transition states. Only the latter approach is consistently satisfactory
A global reduced-dimensional potential energy contour plot is described for the simultaneous represe...
MNDO and MNDOC calculations are reported for 24 reactions of simple organic molecules. The results a...
A global reduced-dimensional potential energy contour plot is described for the simultaneous represe...
Four commonplace concerted reactions are examined using (i) correlation diagrams, (ii) frontier mole...
A novel approach to the evaluation of Hückel and Möbius transition states is described. It employs i...
<p></p><p>In this work is proposed a didactic alternative vision to teach pericyclic reactions. To t...
CAMEO, an interactive computer program that assists in the mechanistic evaluation of organic reactio...
"Pericyclic Chemistry: Orbital Mechanisms and Stereochemistry is a complete guide to the topic that ...
Simple model of preliminary selection of possible reaction pathways for the reaction between multiat...
In the quantum chemical approach, chemical reaction mechanisms are investigated based on a potential...
In this work is proposed a didactic alternative vision to teach pericyclic reactions. To this end, t...
Pathways-reduced analysis is one of the techniques used by the Fispact-II nuclear activation and tra...
This short article very briefly looks at concerted and non-concerted/stepwise pericyclic reactions (...
the concept of concertedness is paramount in all discussions of reaction mechanisms. The criterion t...
A global reduced-dimensional potential energy contour plot is described for the simultaneous represe...
A global reduced-dimensional potential energy contour plot is described for the simultaneous represe...
MNDO and MNDOC calculations are reported for 24 reactions of simple organic molecules. The results a...
A global reduced-dimensional potential energy contour plot is described for the simultaneous represe...
Four commonplace concerted reactions are examined using (i) correlation diagrams, (ii) frontier mole...
A novel approach to the evaluation of Hückel and Möbius transition states is described. It employs i...
<p></p><p>In this work is proposed a didactic alternative vision to teach pericyclic reactions. To t...
CAMEO, an interactive computer program that assists in the mechanistic evaluation of organic reactio...
"Pericyclic Chemistry: Orbital Mechanisms and Stereochemistry is a complete guide to the topic that ...
Simple model of preliminary selection of possible reaction pathways for the reaction between multiat...
In the quantum chemical approach, chemical reaction mechanisms are investigated based on a potential...
In this work is proposed a didactic alternative vision to teach pericyclic reactions. To this end, t...
Pathways-reduced analysis is one of the techniques used by the Fispact-II nuclear activation and tra...
This short article very briefly looks at concerted and non-concerted/stepwise pericyclic reactions (...
the concept of concertedness is paramount in all discussions of reaction mechanisms. The criterion t...
A global reduced-dimensional potential energy contour plot is described for the simultaneous represe...
A global reduced-dimensional potential energy contour plot is described for the simultaneous represe...
MNDO and MNDOC calculations are reported for 24 reactions of simple organic molecules. The results a...
A global reduced-dimensional potential energy contour plot is described for the simultaneous represe...