Crystal structure of (E)-N-(4-bromophenyl)-2cyano-3-[3-(2-methylpropyl)-1-phenyl-1H-pyrazol- 4-yl]prop-2-enamide

被引:1
作者
Abu-Zaied, Mamdouh A. [1 ]
Mohamed-Ezzat, Reham A. [2 ]
Elgemeie, Galal H. [3 ]
Jones, Peter G. [4 ]
机构
[1] Natl Res Ctr, Chem Ind Res Inst, Green Chem Dept, Giza, Egypt
[2] Natl Res Ctr, Pharmaceut & Drug Ind Res Inst, Chem Nat & Microbial Prod Dept, Cairo, Egypt
[3] Helwan Univ, Chem Dept, Fac Sci, Cairo, Egypt
[4] Tech Univ Carolo Wilhelmina Braunschweig, Inst Anorgan & Analyt Chem, Hagenring 30, D-38106 Braunschweig, Germany
关键词
pyrazole; acrylamide; hydrogen bonds; twinning; crystal structure; PYRAZOLE; ANALOGS; PURINE; PYRAZOLOPYRIMIDINE; THIOGLYCOSIDES; DERIVATIVES;
D O I
10.1107/S2056989024003086
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The structure of the title compound, C23H21BrN4O, contains two independent molecules connected by hydrogen bonds of the type Namide-H center dot center dot center dot N equivalent to C to form a dimer. The configuration at the exocyclic C=C double bond is E. The molecules are roughly planar except for the isopropyl groups. There are minor differences in the orientations of these groups and the phenyl rings at N1. The dimers are further linked by 'weak' hydrogen bonds, two each of the types H-phenyl center dot center dot center dot O= C (H center dot center dot center dot O = 2.50, 2.51 angstrom) and H-phenyl center dot center dot center dot Br (H center dot center dot center dot Br = 2.89, 2.91 angstrom), to form ribbons parallel to the b and c axes, respectively. The studied crystal was a non-merohedral twin.
引用
收藏
页码:501 / +
页数:14
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