π -Hole bonding in a new co-crystal hydrate of gallic acid and pyrazine: static and dynamic charge density analysis

This study presents the first comparison between an XWR and a MEM experimental electron-density determination.

Source: Acta Crystallographica Section B - March 23, 2022 Category: Chemistry Authors: Pal, R. Jelsch, C. Momma, K. Grabowsky, S. Tags: cocrystal hydrate π -hole carbon bonding static charge density dynamic charge density quantum crystallography research papers Source Type: research