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

2,2'-(1,2-Phenylene)diacetonitrile * Band gap: 4.09 eV in crystal, 4.78 eV in gas (FUGWOU)
Home Updates Documentation Login/Signup or Logout
New: Dispersion Energies now available! New: Download Optimized Structures in .CIF format