Items for "Packing-induced distortion"

Structures of 6-(substituted-phenyl)fulvenes

The syntheses and crystal structures of a series of 6-(substituted-phenyl) fulvenes are reported. In three instances the molecular structures determined by X-Ray crystallography were compared to the results of DFT calculations...

Keywords: 6-(substituted-phenyl) fulvene, Packing-induced distortion, Hydrogen-bonding, DFT Calculations, Single crystal structure analysis