Crystal design using multipolar electrostatic interactions: A concept study for organic electronics

利用多极静电相互作用进行晶体设计:有机电子学概念研究

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Abstract

Using a simple synthetic protocol, heterohexacene analogues with a quadrupolar distribution of partial charges are readily available. In contrast to most other acenes, these compounds crystallize with a slipped-stack, brickwork-like packing which is mainly controlled by electrostatic interactions. This type of packing offers an advantage for organic semiconductors, because it allows more isotropic charge transport compared to the "herring bone" stacking observed for other acenes.

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