Crystal structure and Hirshfeld surface analysis of (Z)-2-amino-4-(2,6-dichlorophenyl)-5-(1-hydroxyethylidene)-6-oxo-1-phenyl-1,4,5,6-tetrahydropyridine-3-carbonitrile

The molecular conformation of the title compound, C20H15Cl2N3O2, is stabilized by an intramolecular O-H..O hydrogen bond, forming an S(6) ring motif. The central pyridine ring is almost planar [maximum deviation = 0.074 (3) Å]. It subtends dihedral angles of 86.10 (15) and 87.17 (14)°, respectively, with the phenyl and dichlorophenyl rings, which are at an angle of 21.28 (15)° to each other. The =C(-OH)CH3 group is coplanar. In the crystal, molecules are linked by intermolecular N-H..N and C-H..N hydrogen bonds, and N-H..π and C-H..π interactions, forming a three-dimensional network. The most important contributions to the crystal packing are from H..H (33.1%), C..H/H..C (22.5%), Cl..H/H..Cl (14.1%), O..H/H..O (11.9%) and N..H/H..N (9.7%) interactions. © 2021 International Union of Crystallography. All rights reserved.

Авторы
Naghiyev F.N.1 , Pavlov A.V. 2 , Khrustalev V.N. 2, 3 , Akkurt M.4 , Khalilov A.N.1, 5 , Akobirshoeva A.A.6 , Mamedov I.G.1
Издательство
International Union of Crystallography
Язык
Английский
Страницы
930-934
Статус
Опубликовано
Том
77
Год
2021
Организации
  • 1 Department of Chemistry, Baku State University, Z. Khalilov str. 23, Az Baku, 1148, Azerbaijan
  • 2 Peoples' Friendship University of Russia (RUDN University), Miklukho-Maklay St. 6, Moscow, 117198, Russian Federation
  • 3 N. D. Zelinsky Institute of Organic Chemistry Ras, Leninsky Prosp. 47, Moscow, 119991, Russian Federation
  • 4 Department of Physics, Faculty of Sciences, Erciyes University, Kayseri, 38039, Turkey
  • 5 "composite Materials" Scientific Research Center, Azerbaijan State Economic University (UNEC), H. Aliyev str. 135, Baku, 1063, Azerbaijan
  • 6 Acad. Sci. Republ. Tadzhikistan, Kh. Yu. Yusufbekov Pamir Biol. Inst., 1 Kholdorova St, Khorog, Gbao, 736002, Tajikistan
Ключевые слова
Crystal structure; Hirshfeld surface analysis; Hydrogen bonds; Pyridine ring; Ring motifs
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