Ontology highlight
ABSTRACT:
SUBMITTER: Abdel-Wahab BF
PROVIDER: S-EPMC3629653 | biostudies-literature | 2013 Apr
REPOSITORIES: biostudies-literature
Acta crystallographica. Section E, Structure reports online 20130328 Pt 4
In the title compound, C28H23FN6S, the pyrazole ring adopts an envelope conformation, with the methine C atom being the flap atom. With respect to this ring, the 2-thienyl, triazole and fluoro-benzene rings are approximately coplanar, coplanar and perpendicular, respectively [dihedral angles = 8.56 (17), 6.03 (19) and 73.1 (2)°, respectively] so that to a first approximation the mol-ecule has a T-shape. In the crystal, mol-ecules are consolidated into a three-dimensional architecture by C-H⋯F (i ...[more]