Crystal structure of 2-[12-methyl-14-phenyl-10,13,14,16-tetraazatetracyclo-[7.7.0.0(2,7).0(11,15)]hexadeca-1(16), 2,4,6,9,11(15),12-heptaen-8-ylidene]propandinitrile

被引：1
|
作者：
Mague, Joel T. [1 ]
Mohamed, Shaaban K. [2 ,3 ]
Akkurt, Mehmet [4 ]
El-Kashef, Hussein M. S. [5 ]
Albayati, Mustafa R. [6 ]
机构：
[1] Tulane Univ, Dept Chem, New Orleans, LA 70118 USA
[2] Manchester Metropolitan Univ, Chem & Environm Div, Manchester M1 5GD, Lancs, England
[3] Menia Univ, Fac Sci, Chem Dept, El Minia 61519, Egypt
[4] Erciyes Univ, Fac Sci, Chem Dept, TR-38039 Kayseri, Turkey
[5] Assiut Univ, Fac Sci, Chem Dept, Assiut 71515, Egypt
[6] Kirkuk Univ, Coll Sci, Dept Chem, Kirkuk, Iraq
来源：
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS | 2014年 / 70卷
关键词：
crystal structure; heptaene; propandinitrile; pyrazine scaffold compound; fused tetracyclic core;
D O I：
10.1107/S1600536814024167
中图分类号：
O7 [晶体学];
学科分类号：
0702 ; 070205 ; 0703 ; 080501 ;
摘要：
In the title molecule, C22H12N6, the fused tetracyclic core shows a small lengthwise twist as indicated by the dihedral of 2.7 (2)degrees between the outer rings. In the crystal, molecules stack along the b-axis direction via offset pi-stacking [centroid-centroid distances = 3.5282 (13) and 3.5597 (14) angstrom] with the stacks weakly associated through C-H center dot center dot center dot N hydrogen bonds. The phenyl ring is rotationally disordered over two orientations with an occupancy ratio of 0.516 (4):0.484 (4).
引用
收藏
页码：O1244 / +
页数：11
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