10-Methylisoalloxazine 5-oxide from synchrotron powder diffraction data

被引:0
|
作者
Rohlicek, Jan [1 ]
Cibulka, Radek [2 ]
Cibulkova, Jana [3 ]
Maixner, Jaroslav [3 ]
Husak, Michal [1 ]
机构
[1] Prague Inst Chem Technol, Dept Solid State Chem, CR-16628 Prague 6, Czech Republic
[2] Prague Inst Chem Technol, Dept Organ Chem, CR-16628 Prague 6, Czech Republic
[3] Prague Inst Chem Technol, Cent Labs, CR-16628 Prague 6, Czech Republic
关键词
D O I
10.1107/S1600536810048932
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The title compound [systematic name: 10-methylbenzo[g]pteridine-2,4(3H,10H)-dione 5-oxide], C11H8N4O3, consists of a large rigid isoalloxazine group which is approximately planar (r.m.s. deviation = 0.037 angstrom). In the crystal, intermolecular N-H center dot center dot center dot O hydrogen bonds link the molecules into centrosymmetric dimers. Dimers related by translation along the c axis form stacks through pi-pi interactions [centroid-centroid distances = 3.560 (5) and 3.542 (5) angstrom]. Weak intermolecular C-H center dot center dot center dot O interactions further consolidate the crystal packing.
引用
收藏
页码:O3350 / U2268
页数:11
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