Abstract
In the title molecule, C23H14N4, the triazoloisoquinoline ring system is nearly planar, with an r.m.s. deviation of 0.038 (2) Å and a maximum deviation of −0.030 (2) Å from the mean plane of the triazole ring C atom which is bonded to the benzene ring. The benzene and phenyl rings are twisted by 57.65 (8) and 53.60 (9)°, respectively, with respect to the mean plane of the triazoloisoquinoline ring system. In the crystal structure, molecules are linked by weak aromatic π–π interactions [centroid–centroid distance = 3.8074 (12) Å]. In addition, the crystal structure exhibits a nonclassical intermolecular C—H⋯N hydrogen bond.
Highlights
A maximum deviation of 0.030 (2) Å from the mean plane of the triazole ring C atom which is bonded to the benzene ring
Molecules are linked by weak aromatic
As part of our search for new isoquinoline analogues (Khan et al, 2010), we focused on synthesis of titled compounds and the crystal structure is reported
Summary
India, bSolid State and Structural Chemistry Unit, Indian Institute of Science, Bangalore 560 012, Karnataka, India, and cDepartment of Physics, Faculty of Arts and Sciences, Erciyes University, 38039 Kayseri, Turkey. C23H14N4, the triazoloisoquinoline ring system is nearly planar, with an r.m.s. deviation of 0.038 (2) Å and a maximum deviation of 0.030 (2) Å from the mean plane of the triazole ring C atom which is bonded to the benzene ring. The benzene and phenyl rings are twisted by. 57.65 (8) and 53.60 (9) , respectively, with respect to the mean plane of the triazoloisoquinoline ring system. Molecules are linked by weak aromatic – interactions [centroid–centroid distance = 3.8074 (12) Å]. The crystal structure exhibits a nonclassical intermolecular C—H N hydrogen bond
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