2-[(7-乙酰基-4-氰基-6-羟基-1,6-二甲基-8-苯基-5,6,7,8-四氢异喹啉-3-基)硫烷基]-苯乙酰胺的晶体学和光谱表征
Crystallographic and spectroscopic characterization of 2-[(7-acetyl-4-cyano-6-hy-droxy-1,6-dimethyl-8-phenyl-5,6,7,8-tetra-hydro-isoquinolin-3-yl)sulfan-yl]--phenyl-acetamide.
作者信息
Al-Taifi Elham A, Maraei Islam S, Bakhite Etify A, Demirtas Güneş, Mague Joel T, Mohamed Shaaban K, Ramli Youssef
机构信息
Department of Chemistry, Faculty of Science, Sana'a University, Sana'a, Yemen.
Department of Chemistry, Faculty of Science, Assiut University, Assiut, Egypt.
出版信息
Acta Crystallogr E Crystallogr Commun. 2021 Jan 15;77(Pt 2):121-125. doi: 10.1107/S2056989021000372. eCollection 2021 Feb 1.
Abstract
In the title mol-ecule, CHNOS, the heterocyclic portion of the tetra-hydro-iso-quinoline unit is planar and an intra-molecular N-H⋯N hydrogen bond and a C-H⋯π(ring) inter-action help to determine the overall conformation. In the crystal, a layer structure with the layers parallel to (10) is generated by O-H⋯O and C-H⋯O hydrogen bonds.
摘要
在标题分子CHNOS中，四氢异喹啉单元的杂环部分是平面的，分子内N-H⋯N氢键和C-H⋯π(环)相互作用有助于确定整体构象。在晶体中，由O-H⋯O和C-H⋯O氢键形成了与(10)平行的层状结构。
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