(E)-6,8-Dichloro-3-{[(naphthalen-1-ylmethyl) iminiumyl]methyl}-2H-chromen-4-olate

被引:5
作者
Ishikawa, Yoshinobu [1 ]
Motohashi, Yuya [1 ]
机构
[1] Univ Shizuoka, Sch Pharmaceut Sci, Suruga Ku, 52-1 Yada, Shizuoka 4228526, Japan
来源
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS | 2013年 / 69卷
关键词
data-to-parameter ratio = 16.5; meanω(C - C) = 0.002 A °; Rfactor = 0.033; single-crystal X-ray study; T = 100 K; wRfactor = 0.083;
D O I
10.1107/S1600536813018084
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
In the title compound, C21H15Cl2NO2, the H atom of the -OH group is transferred to the N atom of the imine, forming a zwitterion. Thus, there is formation of a six-membered ring via an intramolecular O center dot center dot center dot H-N, rather than O-H center dot center dot center dot N, hydrogen bond in the molecule. The dihedral angle between the naphthalene ring system and the benzene ring of the 2H-chromen system is 87.41 (4)degrees. In the crystal, the molecules are packed through N-H center dot center dot center dot O, pi-pi [centroid-centroid distances = 3.744 (3) and 3.780 (3) angstrom], C-Cl center dot center dot center dot pi [Cl center dot center dot center dot centroid = 3.261 (3) angstrom], C-H center dot center dot center dot pi and C-H center dot center dot center dot O interactions.
引用
收藏
页码:O1226 / +
页数:12
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