Abstract
The mechanism of the reaction of the N-fluoro reagent F‐TEDA‐BF4 with dimethylenebicyclo[3.3.1]nonane was investigated by the semiempirical PM3 SCF MO method using the Cramer–Truhlar SM5.42R solvation model. It was shown that the mechanism of addition of the fluorine corresponds to classical S N 2 nucleophilic substitution involving single-electron transfer synchronous with the cleavage–formation of C—F and N—F bonds.
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Tishchenko, O.V., Serguchev, Y.A., Lur'e, L.F. et al. Quantum-Chemical Investigation of the Mechanism of Transfer of Fluorine in the Reaction of F‐TEDA‐BF4 with Dimethylenebicyclo[3.3.1]nonane. Theoretical and Experimental Chemistry 36, 254–259 (2000). https://doi.org/10.1023/A:1005218311010
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DOI: https://doi.org/10.1023/A:1005218311010