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N-[(3-乙基-苯基)氨基甲酰硫基]-2,2-二苯基乙酰胺

N-[(3-Ethyl-phen-yl)carbamo-thio-yl]-2,2-di-phenyl-acetamide.

作者信息

Yusof Mohd Sukeri Mohd, Razali Nur Rafikah, Arshad Suhana, Rahman Azhar Abdul, Razak Ibrahim Abdul

机构信息

Department of Chemical Sciences, Faculty of Science and Technology, Universiti Malaysia Terengganu, Mengabang Telipot, 21030 Kuala Terengganu, Malaysia.

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2013 Jun 8;69(Pt 7):o1016-7. doi: 10.1107/S1600536813014268. eCollection 2013.

DOI:10.1107/S1600536813014268
PMID:24046599
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3772456/
Abstract

In the title mol-ecule, C23H22N2OS, the di-phenyl-acetyl and ethyl-benzene groups adopt a trans-cis conformation, respectively, with respect to the S atom across the (S=)C-N bonds. This conformation is stabilized by an intra-molecular N-H⋯O hydrogen bond and a weak C-H⋯S hydrogen bond. The ethyl-substituted benzene ring forms dihedral angles of 87.53 (15) and 73.94 (15)° with the phenyl rings. In the crystal, N-H⋯O hydrogen bonds link mol-ecules into chains along [100]. A weak C-H⋯π inter-action is also observed.

摘要

在标题分子C₂₃H₂₂N₂OS中,二苯乙酰基和乙苯基团相对于硫原子分别通过(S=)C-N键采取反式-顺式构象。这种构象通过分子内N-H⋯O氢键和弱C-H⋯S氢键得以稳定。乙基取代的苯环与苯环形成的二面角分别为87.53 (15)°和73.94 (15)°。在晶体中,N-H⋯O氢键将分子沿[100]方向连接成链。还观察到一种弱的C-H⋯π相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/087b/3772456/b4031724186d/e-69-o1016-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/087b/3772456/0fb0bcf41628/e-69-o1016-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/087b/3772456/b4031724186d/e-69-o1016-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/087b/3772456/0fb0bcf41628/e-69-o1016-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/087b/3772456/b4031724186d/e-69-o1016-fig2.jpg

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