Elancheran Ramakrishnan - 4-[2-(1,3-Dioxoisoindolin-2-yl)-1,3-thiazol-4-yl]- benzonitrile

Document created by Elancheran Ramakrishnan on Nov 18, 2016
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  Publication Details (including relevant citation   information):

  IUCrData   (2016).   1   ,   x161117


  The title   isoindole, C18H8N3O2S, crystallizes with two independent molecules   ( and B) in the asymmetric   unit whose geometrical features are similar.   The benzonitrile ring is   oriented at an angle of 2.1 (1) (molecule A) and 16.0 (1)    (molecule B), with respect to the   isoindole ring system. In the crystal, molecules are linked   via   C—H...N hydrogen bonds,   forming C(15)   chains propagating along   along the c   axis.   B   molecules   are linked via C—H....interactions, forming dimers with an   R2(10) graph-set motif. C—H....O and C—H....N interactions,   charcterized by R2(15) and R12(7) motifs, are observed between molecules A and B.

  Address (URL): http://dx.doi.org/10.1107/S2414314616011172