Crystal structure and computational study of 2,4-dichloro-N-[(E)-(5-nitrothiophen-2-yl)methylidene]aniline

Crystal structure and computational study of 2,4-dichloro-N-[(E)-(5-nitrothiophen-2-yl)methylidene]aniline

The title compound, C11H6Cl2N2O2S, is a Schiff base that incorporates an N-bound 2,4-dichlorophenyl and a C-bound 5-nitrothiophene ring. The molecule is approximately planar, the maximum deviation from the mean plane being 0.233 (4) Å for the C=N N atom. The dihedral angle between the benzene and th...

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Bibliographic Details
Main Authors: Yavuz Köysal, Hakan Bülbül, Sümeyye Gümüş, Erbil Ağar, Mustafa Serkan Soylu
Format: Article
Language:English
Published: International Union of Crystallography 2016-08-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
crystal structure
Schiff base
nitrothiophene
π–π interactions
quantum-chemical calculations
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2056989016011816

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http://scripts.iucr.org/cgi-bin/paper?S2056989016011816

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