Cyanomethyl 4-(4-methylbenzenesulfonamido)benzoate


Mustafa G., AKKURT M., Khan I. U., Muhmood T.

ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, cilt.68, 2012 (ESCI) identifier identifier

Özet

The title molecule, C16H14N2O4S, adopts an L-shaped conformation, with the central C-S-N-C torsion angle being -69.1 (3)degrees. The two benzene rings form a dihedral angle of 89.94 (15)degrees. The molecular conformation may be influenced by a weak intramolecular C-H center dot center dot center dot O hydrogen bond which generates an S(6) ring motif. In the crystal, molecules are linked by N-H center dot center dot center dot O and weak C-H center dot center dot center dot O hydrogen bonds, forming chains propagating along the b axis. Weak C-H center dot center dot center dot N hydrogen bonds connect the chains into a two-dimensional network parallel to (011). The crystal studied was an inversion twin, the ratio of components being 0.7 (1):0.3 (1).