The role of secondary bonding on supramolecular assembly of coordination compounds: diversity of coordination modes and supramolecular structures

被引:30
|
作者
Khavasi, Hamid Reza [1 ]
Tahrani, Alireza Azhdari [1 ]
机构
[1] Shahid Beheshti Univ, Fac Chem, Gen Campus, Tehran, Iran
来源
CRYSTENGCOMM | 2013年 / 15卷 / 29期
关键词
DENSITY-FUNCTIONAL THEORY; REGULAR 2-COMPONENT HAMILTONIANS; METAL-ORGANIC FRAMEWORKS; PI-PI STACKING; MOLECULAR-STRUCTURES; HYDROGEN-BONDS; CRYSTAL-STRUCTURES; BUILDING-BLOCKS; POROUS MATERIAL; DESIGN ELEMENT;
D O I
10.1039/c3ce40433a
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
In this study, N-(2-halophenyl)-2-pyrazinecarboxamide ligands, L2-F, L2-Cl, L2-Br, and L2-I, carrying different halogen atoms in the phenyl ortho-position have been employed for the synthesis of twelve mercury(II) complexes. Many of the differences in the structural motifs of these complexes can be attributed to the different halide anions and also the different halogen substituents of the L2-X ligands. The effects of these parameters have been discussed with the help of geometrical analysis and calculations. This study reveals an undeniable contribution from the Hg center dot center dot center dot N-pyz secondary bonding interaction to the organization and stabilization of some of the crystal structures reported here.
引用
收藏
页码:5799 / 5812
页数:14
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