•Plot potential energy curve of 7-Azaindole (7-AI) and formic acid
singlet normal : log (energy : -569.690670 hartree)
ts : log (energy : -569.679377 hartree)
singlet tautomer : log (energy : -569.679662 hartree)
irc : output
excited state
singlet normal : log (energy : -569.533359 hartree)
ts : log (energy : -569.548107 hartree)
singlet tautomer : log (energy : -569.551886 hartree)
