N-Methyl-N-(2-nitrophenyl)nitramine and N-methyl-N-(3-nitrophenyl)nitramine. 2005

Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
Institute of Chemistry, University of Opole, Oleska 48, 45-052 Opole, Poland.

The structures of the two title isomeric compounds (systematic names: N-methyl-N,2-dinitroaniline and N-methyl-N,3-dinitroaniline, both C7H7N3O4) are slightly different because they exhibit different steric hindrances and hydrogen-bonding environments. The aromatic rings are planar. The -N(Me)NO2 and -NO2 groups are not coplanar with the rings. Comparison of the geometric parameters of the ortho, meta and para isomers together with those of N-methyl-N-phenylnitramine suggests that the position of the nitro group has a strong influence on the aromatic ring distortion. The crystal packing is stabilized by weak C-H...O hydrogen bonds to the nitramine group.

UI MeSH Term Description Entries

Related Publications

Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
September 2004, Acta crystallographica. Section C, Crystal structure communications,
Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
September 2012, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy,
Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
March 2023, IUCrData,
Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
August 2002, Acta crystallographica. Section C, Crystal structure communications,
Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
May 2001, Acta crystallographica. Section C, Crystal structure communications,
Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
September 2001, Acta crystallographica. Section C, Crystal structure communications,
Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
November 1995, Journal of pharmaceutical sciences,
Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
February 2000, Acta crystallographica. Section C, Crystal structure communications,
Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
March 2001, Journal of pharmaceutical sciences,
Bartosz Zarychta, and Anna Piecyk-Mizgała, and Zdzisław Daszkiewicz, and Jacek Zaleski
January 2008, Acta crystallographica. Section E, Structure reports online,
Copied contents to your clipboard!