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Pericyclic reactions orbital phase correlations

From the foregoing discussion it appears that the frontier orbital method is at once a simple, concise, and accurate method for assessing the stereochemical outcome of pericyclic reactions. Furthermore, it is a method that is equally applicable to symmetrical and to unsymmetrical systems. There are some disadvantages in the theory, however. Firstly, it is necessary to derive the general phase characteristics of the HOMO and LUMO levels. Hiickel molecular calculations can be used for tliis purpose, but there are available a number of approximate methods, for example the electron-in-a-box model, which are usually satisfactory even if they are more difficult to apply to more complex systems. Nevertheless, frontier orbital analysis is quicker and more simple than the formalized correlation diagram approach, and with a little practice one can intuitively arrive at the correct relative phase relationsliips in the HOMO and LUMO levels. [Pg.107]


See other pages where Pericyclic reactions orbital phase correlations is mentioned: [Pg.344]    [Pg.450]    [Pg.197]    [Pg.197]    [Pg.42]    [Pg.50]    [Pg.471]    [Pg.197]    [Pg.197]    [Pg.450]    [Pg.214]   
See also in sourсe #XX -- [ Pg.391 ]




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Correlating orbitals

Orbitals phase

Orbitals phasing

Orbitals reaction

Pericyclic

Pericyclic reactions

Phase correlation

Phase orbit

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