This database is currently under development! Expect some links not to be active. New features are added weekly.

Methoxycarbonylmethyl 3-hydroxy-2-(methoxycarbonyl)benzo(b)furan-6-carboxylate * Band gap: 2.47 eV in crystal, 2.65 eV in gas (HULKII)
Home Updates Documentation Login/Signup or Logout
New: Dispersion Energies now available! New: Download Optimized Structures in .CIF format