Back to Search Start Over

Redetermination of 2-methyl-4-nitropyridine N-oxide

Authors :
Max Peukert
Wilhelm Seichter
Edwin Weber
Source :
Acta Crystallographica Section E, Vol 70, Iss 4, Pp o426-o427 (2014)
Publication Year :
2014
Publisher :
International Union of Crystallography, 2014.

Abstract

An improved crystal structure of the title compound, C6H6N2O3, is reported. The structure, previously solved [Li et al. (1987). Jiegou Huaxue (Chin. J. Struct. Chem.), 6, 20–24] in the orthorhombic space group Pca21 and refined to R = 0.067, has been solved in the orthorhombic space group Pbcm with data of enhanced quality, giving an improved structure (R = 0.0485). The molecule adopts a planar conformation with all atoms lying on a mirror plane. The crystal structure is composed of molecular sheets extending parallel to the ab plane and connected via C—H...O contacts involving ring H atoms and O atoms of the N-oxide and nitro groups, while van der Waals forces consolidate the stacking of the layers.

Subjects

Subjects :
Crystallography
QD901-999

Details

Language :
English
ISSN :
16005368
Volume :
70
Issue :
4
Database :
Directory of Open Access Journals
Journal :
Acta Crystallographica Section E
Publication Type :
Academic Journal
Accession number :
edsdoj.104d651d7e814bbca282f84e8718fbb3
Document Type :
article
Full Text :
https://doi.org/10.1107/S1600536814004450