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Atomic and Molecular Properties, and Heat of Formation
   
  A formula is provided for every molecule submitted. If the molecule exists in the SSPD, the molecule will also be given a proper name. Atomic and Molecular Properties available for all molecules include:

• R/S chirality
• Weight
• Area and Polar Surface Area
• Volume
• LogP
• Vicinal coupling constants
• Measure of distances, angles, and dihedral angles

Additional properties provided for either SSPD entries or directly from calculations made with iSpartan Server include:

• Chemical shifts
• Atomic charges
• Heat of formation (using the successful T1 thermochemical recipe)
• Dipole moment