Author/Authors :
Jaroslaw Saczewski، نويسنده , , Jaros?aw and Frontera، نويسنده , , Antonio and Gdaniec، نويسنده , , Maria and Brzozowski، نويسنده , , Zdzis?aw and S?czewski، نويسنده , , Franciszek and Tabin، نويسنده , , Piotr and Qui?onero، نويسنده , , David and Deyà، نويسنده , , Pere M.، نويسنده ,
Abstract :
In this Letter, we describe the synthesis of several bis(thiocarbamoyl) disulfides that present interesting intramolecular S⋯N and S⋯S interactions. In one case, crystals suitable for X-ray characterization have been obtained. The non-covalent interactions have been studied analyzing the crystal structure and by means of high level density functional theory (DFT) calculations (RI-PB86/TZVP) using both ‘atoms-in-molecules’ (AIM) and natural bond orbital (NBO) analyses.