Dai Jing, Wen Xiao-Chun
Ordered Matter Science Research Center, College of Chemistry and Chemical Engineering, Southeast University, Nanjing 210096, People's Republic of China.
Acta Crystallogr Sect E Struct Rep Online. 2008 Oct 15;64(Pt 11):o2113. doi: 10.1107/S1600536808032649.
In the title compound, C(6)H(6)N(5) (+)·Cl(-), the pyridinium and tetra-zole rings are essentially coplanar. The pyridine N atoms are protonated. In the crystal structure, mol-ecules are connected via N-H⋯Cl, C-H⋯Cl, C-H⋯N and N-H⋯N hydrogen bonds into layers that are parallel to the (001) plane. There are two crystallographically independent mol-ecules in the asymmetric unit which are located on mirror planes.
在标题化合物C(6)H(6)N(5)⁺·Cl⁻中,吡啶鎓环和四唑环基本共面。吡啶氮原子被质子化。在晶体结构中,分子通过N-H⋯Cl、C-H⋯Cl、C-H⋯N和N-H⋯N氢键连接成平行于(001)平面的层。不对称单元中有两个晶体学独立的分子,它们位于镜面上。