Charge-transfer character of halogen bonding:: Molecular structures and electronic spectroscopy of carbon tetrabromide and bromoform complexes with organic σ- and π-donors

被引:126
作者
Rosokha, S. V. [1 ]
Neretin, I. S. [1 ]
Rosokha, T. Y. [1 ]
Hecht, J. [1 ]
Kochi, J. K. [1 ]
机构
[1] Univ Houston, Dept Chem, Houston, TX 77204 USA
关键词
D O I
10.1002/hc.20264
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Carbon tetrabromide and bromoform are employed as prototypical electron acceptors to demonstrate the charge-transfer nature of various intermolecular complexes with three different structural types of electron donors represented by (1) halide and pseudohalide anions, (2) aromatic (pi-bonding) hydrocarbons, and (3) aromatics with (n-bonding) oxygen or nitrogen centers. UV-Vis spectroscopy identifies the electronic transition inherent to such [1:1] complexes; and their Mulliken correlation with the donor/acceptor strength verifies the relevant charge-transfer character X-ray crystallography of CBr(4)/HCBr(3) complexes with different types of donors establishes the principal structural features of halogen bonding. (c) 2006 Wiley Periodicals, Inc.
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页码:449 / 459
页数:11
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