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2-[(E)-2-羟基-5-(三氟甲氧基)亚苄基氨基]-4-甲基苯酚

2-[(E)-2-Hy-droxy-5-(trifluoro-meth-oxy)benzyl-idene-amino]-4-methyl-phenol.

作者信息

Karadağ Aslı Tosyalı, Atalay Sehriman, Genç Hasan

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2010 Dec 11;67(Pt 1):o95. doi: 10.1107/S1600536810050579.

DOI:10.1107/S1600536810050579
PMID:21522804
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3050197/
Abstract

The title compound, C(15)H(12)F(3)NO(3), is a Schiff base which adopts the cis-quinoid form in the solid state. The dihedral angle between the least-squares planes of the benzene rings being 3.6 (1)°. The F atoms of the -CF(3) group are disordered over two sets of sites with refined occupancies of 0.61 (5) and 0.39 (5). An intra-molecular N-H⋯O hydrogen bond occurs. The crystal structure is stabilized by inter-molecular O-H⋯O hydrogen bonds.

摘要

标题化合物C(15)H(12)F(3)NO(3)是一种席夫碱，在固态时呈顺式醌型。苯环的最小二乘平面之间的二面角为3.6 (1)°。-CF(3)基团的F原子在两组位置上无序，精修占有率分别为0.61 (5)和0.39 (5)。分子内存在N-H⋯O氢键。晶体结构通过分子间的O-H⋯O氢键得以稳定。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b20b/3050197/5450e152de02/e-67-00o95-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b20b/3050197/98032b5c843e/e-67-00o95-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b20b/3050197/5450e152de02/e-67-00o95-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b20b/3050197/98032b5c843e/e-67-00o95-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/b20b/3050197/5450e152de02/e-67-00o95-fig2.jpg

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