5-甲基-N-[2-硝基-4-(三氟甲基)苯基]-1H-吡唑-3-胺：由氢键连接的R(2)(2)(6)和R(2)(2)(16)环构成的链。
5-Methyl-N-[2-nitro-4-(trifluoromethyl)phenyl]-1H-pyrazole-3-amine: a chain of hydrogen-bonded R(2)(2)(6) and R(2)(2)(16) rings.
作者信息
Portilla Jaime, Ontiveros Ina, Cobo Justo, Glidewell Christopher
机构信息
Grupo de Investigacíon en Compuestas Bio-orgánicos, Departamento de Química, Universidad de los Andes, Cra. 1E No. 18a-10, edificioQ, AA 4976, Bogotá DC, Colombia.
出版信息
Acta Crystallogr C. 2013 Feb;69(Pt 2):172-4. doi: 10.1107/S0108270113000607. Epub 2013 Jan 12.
The molecular skeleton of the title compound, C(11)H(9)F(3)N(4)O(2), is almost planar and exhibits a polarized (charge-separated) electronic structure in the nitroaniline portion. Molecules are linked by N-H···N and C-H···O hydrogen bonds to form a chain in which centrosymmetric R(2)(2)(6) and R(2)(2)(16) rings alternate.
标题化合物C(11)H(9)F(3)N(4)O(2)的分子骨架几乎呈平面状，且在硝基苯胺部分呈现出极化（电荷分离）的电子结构。分子通过N-H···N和C-H···O氢键相连形成一条链，其中中心对称的R(2)(2)(6)环和R(2)(2)(16)环交替出现。
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