In this contribution, we review our recent quantum-chemical studies on inte
rmolecular interactions and the way they impact the transport and optical p
roperties of organic conjugated materials. When applied to the crystalline
structures of two prototypical oligomeric materials, alpha -sexithienyl and
alpha-alpha ' -bisdithieno[3,2-b:2 ' ,3 ' -d]thiophen our approach illustr
ates how the variations in chain packing lead to dramatically different opt
ical splittings and carrier mobilities. Various strategies to prevent solid
-state luminescence quenching in light-emitting devices are proposed.