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Methyl 4-anilino-3-nitro-benzoate.


ABSTRACT: In the mol-ecule of the title compound, C(14)H(12)N(2)O(4), the aromatic rings are oriented at a dihedral angle of 51.50?(4)°. An intra-molecular N-H?O inter-action results in the formation of a six-membered ring having an envelope conformation. In the crystal structure, inter-molecular N-H?O inter-actions link the mol-ecules into centrosymmetric dimers. ?-? contacts between the benzene rings [centroid-centroid distance = 3.708?(1)?Å] may further stabilize the structure.

SUBMITTER: Li HY 

PROVIDER: S-EPMC2969563 | biostudies-literature | 2009 May

REPOSITORIES: biostudies-literature

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Methyl 4-anilino-3-nitro-benzoate.

Li Hao-Yuan HY   Wu Yong-Zhong YZ   Liu Bo-Nian BN   Tang Shi-Gui SG   Guo Cheng C  

Acta crystallographica. Section E, Structure reports online 20090523 Pt 6


In the mol-ecule of the title compound, C(14)H(12)N(2)O(4), the aromatic rings are oriented at a dihedral angle of 51.50 (4)°. An intra-molecular N-H⋯O inter-action results in the formation of a six-membered ring having an envelope conformation. In the crystal structure, inter-molecular N-H⋯O inter-actions link the mol-ecules into centrosymmetric dimers. π-π contacts between the benzene rings [centroid-centroid distance = 3.708 (1) Å] may further stabilize the structure. ...[more]

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