Crystal structures of isomeric 4-bromo-N-[(2-nitrophenyl) sulfonyl]benzamide and 4-bromo-N-[(4- nitrophenyl)sulfonyl]benzamide
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Original research
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The syntheses and crystal structures of the isomeric 4-bromo-N-[(2-nitrophenyl)
sulfonyl]benzamide, (I), and 4-bromo-N-[(4-nitrophenyl)sulfonyl]benzamide,
(II), are described (molecular formula = C13H9BrN2O5S in each case). The
asymmetric unit of (I) contains two independent molecules [(IA) and (IB)],
while that of (II) contains one molecule. The benzoic acid aromatic ring of
molecule (IA) is disordered due to rotation about the Car—C( O) bond over
two orientations in a 0.525 (9):0.475 (9) ratio. The dihedral angle between the
benzene rings is 85.9 (3) in (IA) and 65.22 (19) in (IB), while in (II), the
corresponding value is 56.7 (7). In the crystals of (I) and (II), N—H  O, C—
H  O and C—H   interactions generate three-dimensional networks.

Journal
Title
Acta Crystallographica Section E
Publisher
Crystallographic Communications
Publisher Country
United Kingdom
Indexing
Thomson Reuters
Impact Factor
0.5
Publication Type
Both (Printed and Online)
Volume
73
Year
2017
Pages
314-317