The compound with the SMILES O=C(O)C1=C(C(=O)O)NSN1 has an aqueous phase molecular energy at the PBE level of theory of -962.67406 Hartree.
The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} has an {solutionEnergy__names__noun} of {solutionEnergy#} {solutionEnergy__units}.