The crystallisation propensity of the newly synthesised molecule persulfurated coronene has been investigated through a number of experimental methods. Electrostatic potential calculations and multi-molecular optimisations show that face-face interactions are far more favorable than edge-face interactions, severely restricting the ability of the molecule to crystallise.
|Number of pages||4|
|Journal||Journal of the Chemical Society: Chemical Communications|
|Publication status||Published - 14 Nov 2019|