Abstract
The molecule of the title compound, C
11H
8BrN
3O, is close to planar (r.m.s. deviation of all 16 non-H atoms = 0.103 Å), a conformation stabilized by an intramolecular N-H
![...](http://scripts.iucr.org/logos/entities/ctdot_rmgif.gif)
N hydrogen bond, which generates an
S(5) ring. In the crystal structure, supramolecular chains mediated by C-H
![...](http://scripts.iucr.org/logos/entities/ctdot_rmgif.gif)
O contacts (along
a) are linked into a double layer
via N
![...](http://scripts.iucr.org/logos/entities/ctdot_rmgif.gif)
Br halogen bonds [3.207 (5) Å] and C-Br
![...](http://scripts.iucr.org/logos/entities/ctdot_rmgif.gif)
![[pi]](http://scripts.iucr.org/logos/entities/pi_rmgif.gif)
interactions [Br
![...](http://scripts.iucr.org/logos/entities/ctdot_rmgif.gif)
ring centroid(pyrazine) = 3.446 (3) Å]. The layers stack along the
b axis
via weak
![[pi]](http://scripts.iucr.org/logos/entities/pi_rmgif.gif)
–
![[pi]](http://scripts.iucr.org/logos/entities/pi_rmgif.gif)
interactions [ring centroid(pyrazine)
![...](http://scripts.iucr.org/logos/entities/ctdot_rmgif.gif)
ring centroid(benzene) distance = 3.803 (4) Å].
Keywords: None
Document Type: Research Article
DOI: http://dx.doi.org/
10.1107/S1600536810039036
Publication date: 1 de Janeiro de 2010