A DFT study of spherands containing five anisyl groups--Highly preorganized to bind the alkali metal

Authors :: Elroby, Shabaan A.K.
Lee, Kyu Hwan
Cho, Seung Joo
Hinchliffe, Alan
Source :: Canadian Journal of Chemistry. August 2006, Vol. 84 Issue 8, p1045, 5 p.
Publication Year :: 2006
Abstract: Abstract: Although anisyl units are basically poor ligands for metal ions, the rigid placements of their oxygens during synthesis rather than during complexation are undoubtedly responsible for the enhanced binding [...]

Subjects :: Binding energy -- Research -- Usage
Density functionals -- Usage -- Research
Ligands -- Research -- Usage
Chemistry
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Research

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