The chemical with the SMILES representation of O=C(O)c1cc2ccccc2nn1 has a cavity formation energy at the PBE level of theory of 5.620 kT.
The {#molecule|compound|chemical|molecular species|chemical compound!} with the {SMILES__description} {#representation of |!}{SMILES#} has a {cavityEnergy__names__noun} of {cavityEnergy#} {cavityEnergy__units}.