An unprecedented route to achieve persistent 1H-azirine
Submitted by Jun Zhu on Sun, 04/30/2023 - 09:24
1H-azirine, a highly reactive, antiaromatic, and unstable tautomer of the aromatic, stable, and (sometimes) isolable 2H-azirine, is stabilized, both thermodynamically and kinetically, via an unprecedented route, where the latter serves as the precursor–exploiting electronic and steric elements. Our density functional theory results invite experimentalists to realize isolable 1H-azirine.