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2-氨基-7,7-二甲基-5-氧代-4-(对甲苯基)-5,6,7,8-四氢-4H-色烯-3-甲腈

2-Amino-7,7-dimethyl-5-oxo-4-(p-tol-yl)-5,6,7,8-tetra-hydro-4H-chromene-3-carbonitrile.

作者信息

Anthal Sumati, Brahmachari Goutam, Laskar Sujay, Banerjee Bubun, Kant Rajni, Gupta Vivek K

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Aug 1;68(Pt 8):o2592-3. doi: 10.1107/S1600536812033570. Epub 2012 Jul 28.

DOI:10.1107/S1600536812033570
PMID:22905016
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3415029/
Abstract

In the title mol-ecule, C(19)H(20)N(2)O(2), the cyclo-hexene ring adopts a sofa conformation, while the pyran ring adopts a flattened boat conformation. In the crystal, mol-ecules are linked by N-H⋯N and N-H⋯O hydrogen bonds, forming a two-dimensional network parallel to (010).

摘要

在标题分子C(19)H(20)N(2)O(2)中,环己烯环呈沙发构象,而吡喃环呈扁平船式构象。在晶体中,分子通过N - H⋯N和N - H⋯O氢键相连,形成平行于(010)的二维网络。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbdf/3415029/093bae9767f4/e-68-o2592-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbdf/3415029/bd26acb96a50/e-68-o2592-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbdf/3415029/093bae9767f4/e-68-o2592-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbdf/3415029/bd26acb96a50/e-68-o2592-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fbdf/3415029/093bae9767f4/e-68-o2592-fig2.jpg

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