Selective recognition of aromatic hydrocarbons by endo-functionalized molecular tubes via C/N-H ••• π interactions
Selective recognition of aromatic hydrocarbons by endo-functionalized molecular tubes via C/N-H ••• π interactions
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DOI：
10.1016/j.cclet.2017.07.005
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发表时间：
2018-01-01
影响因子：
9.1
通讯作者：
Jiang, Wei
中科院分区：
文献类型：
--
作者：
Huang, Guo-Bao;Liu, Wei-Er;Jiang, Wei
用核磁共振氢谱、计算方法和单晶X射线结晶学研究了四种内官能化分子管对芳香烃的分子识别作用。通过形状互补和偶极排列使结合选择性合理化。非共价相互作用主要是C/N-H中心点pi相互作用。(三)2017中国化学学会、中国医学科学院药物所。爱思唯尔出版，版权所有。
Molecular recognition of aromatic hydrocarbons by four endo-functionalized molecular tubes has been studied by H-1 NMR spectroscopy, computational methods, and single crystal X-ray crystallography. The binding selectivity is rationalized by invoking shape complementarity and dipole alignment. The non covalent interactions are proved to predominantly be C/N-H center dot center dot center dot pi interactions. (C) 2017 Chinese Chemical Society and Institute of Materia Medica, Chinese Academy of Medical Sciences. Published by Elsevier B.V. All rights reserved.