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

页码：O1244 / +

页数：11

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