Ontology highlight
ABSTRACT:
SUBMITTER: Khan FN
PROVIDER: S-EPMC2979237 | biostudies-literature | 2010 Apr
REPOSITORIES: biostudies-literature
Acta crystallographica. Section E, Structure reports online 20100417 Pt 5
In the title mol-ecule, C(22)H(14)ClN(3), the triazoloisoquinoline ring system is approximately planar, with an r.m.s. deviation of 0.033 (2) Å and a maximum departure from the mean plane of 0.062 (1) Å for the triazole ring C atom, bonded to the benzene ring. The benzene and phenyl rings are twisted by 57.02 (6) and 62.16 (6)°, respectively, to the mean plane of the triazoloisoquinoline ring system. The mol-ecule is stabilized by a weak intra-molecular π-π inter-action [centroid-centroid distan ...[more]