The compound with the SMILES representation of O=C1CC(=O)c2cc(O)ccc21 has a aqueous phase LUMO energy at the PBE level of theory of -0.06265 Hartree.
The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} has a {solutionLumo__names__noun} of {solutionLumo#} {solutionLumo__units}.