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（E）-4-羟基-2-{[（2-苯基-乙基）亚胺基]甲基}苯酚盐

(E)-4-Hy-droxy-2-{[(2-phenyl-eth-yl)iminium-yl]meth-yl}phenolate.

作者信息

Ortegon-Reyna David, Garcias-Morales Cesar, García-Báez Efren V, Ariza-Castolo Armando, Martínez-Martínez Francisco J

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Jul 1;68(Pt 7):o2075. doi: 10.1107/S1600536812025408. Epub 2012 Jun 13.

DOI:10.1107/S1600536812025408
PMID:22798757
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3393892/
Abstract

The title Schiff base compound, C(15)H(15)NO(2), crystallized as the iminium-phenolate zwitterion. The H atom is localized on the imine N atom, forming a strong intra-molecular hydrogen bond with the phenolate O atom, and giving rise to an S(6) ring motif. The mol-ecule has an E conformation about the C=N bond. In the crystal, mol-ecules are linked by O-H⋯O hydrogen bonds, forming chains propagating along [010]. There are also C-H⋯O inter-actions present.

摘要

席夫碱化合物C(15)H(15)NO(2)以亚胺正离子-酚盐两性离子形式结晶。氢原子定位于亚胺氮原子上，与酚盐氧原子形成强的分子内氢键，产生S(6)环模式。分子围绕C=N键呈E构象。在晶体中，分子通过O-H⋯O氢键相连，形成沿[010]方向延伸的链。还存在C-H⋯O相互作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/009f/3393892/83857b362fdb/e-68-o2075-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/009f/3393892/ee3d602f30a2/e-68-o2075-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/009f/3393892/83857b362fdb/e-68-o2075-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/009f/3393892/ee3d602f30a2/e-68-o2075-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/009f/3393892/83857b362fdb/e-68-o2075-fig2.jpg

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