PERICYCLIC REACTIONS

For many years, as mechanistic organic chemistry developed, chemists collected examples of peculiar reactions that had no apparent mechanisms. With enough examples identified, some common characteristics could be listed:

In 1965, Woodward and Hoffman suggested that these reactions were driven by conservation of orbital symmetry: the maintenance of maximum bonding interactions by transferring electrons between molecular orbitals of the same symmetry in reactant and products.

REFERENCES

Three principal kinds of pericyclic processes have been described:

Electrocyclic reactions -
ring opening and closing
Examples and Terminology
Cycloadditions - ring formations
from two or more molecules
Examples and Terminology
Sigmatropic rearrangements -
bond migrations
Examples and Terminology

During the years since the Woodward-Hoffman proposal, three principal ways of understanding these reactions have developed:

  1. Frontier orbital analysis, which is the original Woodward-Hoffman method; one examines the HOMO of a single molecule, or a HOMO and a LUMO from a reacting pair. Cf.: Fleming, "Molecular Orbitals and Organic Chemical Reactions", John Wiley and Sons, New York, 2009.

    Example analyses for:

    Electrocyclics Cycloadditions Sigmatropics

  2. The construction of correlation diagrams, which follow the fate of all electrons involved in a reaction. This method, discussed extensively by Woodward and Hoffman in their Angewandte review, was originally suggested by Longuet-Higgins.

    Electrocyclics Cycloadditions Sigmatropics

  3. Identification of aromatic and antiaromatic transition states, with Huckel or Mobius topologies, methodology proposed by Dewar and Zimmerman. Cf.: Dewar and Dougherty, "The PMO Theory of Organic Chemistry", Plenum Press, New York, 1975; and Zimmerman, Acc. Chem. Res., 1971, 4, 272.

    Huckel and Mobius Topologies

    Electrocyclics Cycloadditions Sigmatropics

    Each of these modes of analysis has advantages; however, the Dewar-Zimmerman method is the easiest to apply. We shall use chiefly this methodology in working the assigned problems.


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