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- W331035545 abstract "The theory of conservation of orbital symmetry in concerted reactions, outlined by Woodward and Hoffman, plays the dominant role in the prediction of the stereospecificity of these reactions both in the ground state and in excited states. Despite the importance of this theory with regard to preference for the conrotatory or dysrotatory pathway of cyclization, quantum chemical calculations of the critical portions of the potential energy surface of the ground and excited states become necessary in understanding the detailed mechanism of both thermal and photochemical transformations. The authors use these calculations to find, in the absence of symmetry, the potential energy surfaces of these states for 1,3,5-hexatriene and analyze the allowed and forbidden reaction pathways in its cyclization." @default.
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- W331035545 date "1987-08-01" @default.
- W331035545 modified "2023-09-24" @default.
- W331035545 title "Asymmetrical reaction pathways for thermal and photocyclization of 1,3,5-hexatriene to 1,3-cyclohexadiene" @default.
- W331035545 hasPublicationYear "1987" @default.
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