The compound with the SMILES representation of Nc1nc2c(N)c(N)c(N)nc2c(N)c1N has a gaseous phase HOMO energy at the PBE level of theory of -0.22682 Hartree.
The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} has a {gasHomo__names__noun} of {gasHomo#} {gasHomo__units}.