B-H[three dots, centered][small pi]: a nonclassical hydrogen bond or dispersion contact?

5 years ago

B-H[three dots, centered][small pi]: a nonclassical hydrogen bond or dispersion contact?

Jindrich Fanfrlik, Pavel Hobza, Jan Rezac, Drahomir Hnyk, Robert Sedlak, Adam Pecina, Martin Lepsik

Quantum mechanical calculations disprove the attractive electrostatic nature of B-H[three dots, centered][small pi] motif and define it as dispersion-driven contact.

Publisher URL: http://feeds.rsc.org/~r/rss/CP/~3/DwRLjVwUOOU/C7CP02762A

DOI: 2017/CP/C7CP02762A

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