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Title: Crystal structure of 2-azido-1 H -imidazole-4,5-dicarbonitrile

We report that in the title compound, C 5HN 7, the nitrile and azido substituents are close to being coplanar with the central ring. Molecules in the crystal are linked via an N—H...N hydrogen bond to a nitrile acceptor, forming a chain extending along the c-axis direction.
Authors:
 [1] ;  [1] ;  [1] ;  [1]
  1. Los Alamos National Lab. (LANL), Los Alamos, NM (United States)
Publication Date:
Report Number(s):
LA-UR-15-23927; LA-UR-15-23325
Journal ID: ISSN 2056-9890; ACSECI; PII: S2056989015013444
Grant/Contract Number:
AC52-06NA25396
Type:
Accepted Manuscript
Journal Name:
Acta Crystallographica. Section E, Crystallographic Communications
Additional Journal Information:
Journal Volume: 71; Journal Issue: 9; Journal ID: ISSN 2056-9890
Publisher:
International Union of Crystallography
Research Org:
Los Alamos National Lab. (LANL), Los Alamos, NM (United States)
Sponsoring Org:
USDOE National Nuclear Security Administration (NNSA)
Country of Publication:
United States
Language:
English
Subject:
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY; Crystal structure; organic chemistry; hydrogen bonding; 2-azido-4,5-dicyano-1H-imidazole; 36 MATERIALS SCIENCE; imidazole; crystal structure; 2-azido-4,5-di­cyano-1H-imidazole
OSTI Identifier:
1254852
Alternate Identifier(s):
OSTI ID: 1321758