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Crystal structure of tetraethylammonium fluoride-water (4/11), 4(C2H5)4N+F− · 11H2O,a clathrate hydrate containing linear chains of edge-sharing (H2O)4F− tetrahedra and bridging water molecules
Authors:Thomas C. W. Mak
Affiliation:(1) Department of Chemistry, The Chinese University of Hong Kong, Shatin, New Territories, Hong Kong
Abstract:
Crystals of 4(C2H5)4N+F · 11H2O are orthorhombic, space groupPna21, witha=16.130(3),b=16.949(7),c=17.493(7) Å, andZ=4. The structure was shown to be a clathrate hydrate containing infinite chains of edge-sharing (H2O)4F tetrahedra extending parallel to thea axis. The chains are laterally linked by bridging water molecules to form a three-dimensional hydrogen-bonded anion/water framework. The ordered (C2H5)4N+ cations occupy the voids in two open channel systems running in theb andc directions. FinalRF=0.091 for 2278 observed MoK agr data measured at 22°C.Supplementary Data: relating to this article are deposited with the British Library as Supplementary Publication No. SUP 82010 (20 pages).Dedicated to Professor H. M. Powell.
Keywords:Crystal structure  clathrate hydrate  hydrogen bonding  tetraethylammonium fluoride
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