| Literature DB >> 17917750 |
Hang Cong1, Yun-Jie Zhao, Sai-Feng Xue, Zhu Tao, Qian-Jiang Zhu.
Abstract
The interaction between tetramethylcucurbit[6]uril (host) and 5,5'-dimethyl-2,2'-bipyridyl hydrochloride (guest) was studied by 1H NMR, X-ray crystallography, electronic absorption spectroscopy, fluorescence emission spectra and quantum chemistry calculations. This experimental-computational study that indicated the host can orientationally encapsulate the guest with a moderate association constant value. Computation qualitatively explained the split UV-visible absorption peak of the inclusion complex.Entities:
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Year: 2007 PMID: 17917750 DOI: 10.1007/s00894-007-0243-2
Source DB: PubMed Journal: J Mol Model ISSN: 0948-5023 Impact factor: 1.810