4.7 Article

Coordinated nitrate anions can be directional π-hole donors in the solid state: a CSD study

期刊

CRYSTENGCOMM
卷 19, 期 31, 页码 4485-4488

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ROYAL SOC CHEMISTRY
DOI: 10.1039/c7ce01266g

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  1. Netherlands Organisation for Scientific Research (NWO) [723.015.006]

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A comprehensive Cambridge Structure Database evaluation reveals grouping and significant van der Waals overlap of sp(2) O-atoms above/below the N-atom of coordinated nitrate anions. Overlap of van der Waals shells increases with increased coordination and 84% of close contacts involve anti-electrostatic NO3-center dot center dot center dot NO3- interactions.

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