Anions coordinating anions: analysis of the interaction between anionic Keplerate nanocapsules and their anionic ligands

作者:Melgar Dolores; Bandeira Nuno A G; Avalos Josep Bonet; Bo Carles
来源:Physical Chemistry Chemical Physics, 2017, 19(7): 5343-5350.
DOI:10.1039/c6cp08511c

摘要

Keplerates are a family of anionic metal oxide spherical capsules containing up to 132 metal atoms and some hundreds of oxygen atoms. These capsules holding a high negative charge of -12 coordinate both mono-anionic and di-anionic ligands thus increasing their charge up to -42, even up to -72, which is compensated by the corresponding counter-cations in the X-ray structures. We present an analysis of the relative importance of several energy terms of the coordinate bond between the capsule and ligands like carbonate, sulphate, sulphite, phosphinate, selenate, and a variety of carboxylates, of which the overriding component is contributed by solvation/de-solvation effects.

  • 出版日期2017-2-21