Theoretical design of new macrocycles for nucleophilic fluorination with KF: thiourea-crown-ether is predicted to overcome [2.2.2]-cryptand (original) (raw)
Theoretical design of new macrocycles for nucleophilic fluorination with KF: thiourea-crown-ether is predicted to overcome [2.2.2]-cryptand
Molecular Systems Design & Engineering
Josefredo PliegoAbstract
A new macrocycle combining thiourea and crown ether groups is able to solubilize KF and promote fluorination via stabilization of the SN2 transition state via four hydrogen bonds.
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