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5-[(4-Benzyl-1H-1,2,3-triazol-1-yl)meth-yl]-5H-dibenzo[b,f]azepine.

ABSTRACT: In the title compound, C24H20N4, the azepine ring adopts a boat conformation and the dihedral angle between the benzene rings fused to it is 57.95?(8)°. The bond-angle sum at the azepine N atom is 346.6°, indicating a significant deviation from planarity. The triazole ring subtends a dihedral angle of 71.45?(10)° with the terminal phenyl group. A weak intra-molecular C-H?Na (a = azepine) inter-action occurs, which closes an S(6) ring.

SUBMITTER: Manjunath BC

PROVIDER: S-EPMC3793737 | biostudies-literature | 2013

REPOSITORIES: biostudies-literature

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5-[(4-Benzyl-1H-1,2,3-triazol-1-yl)meth-yl]-5H-dibenzo[b,f]azepine.

Manjunath B C BC Vinay Kumar K S KS Madan Kumar S S Sadashiva M P MP Lokanath N K NK

Acta crystallographica. Section E, Structure reports online 20130710 Pt 8

In the title compound, C24H20N4, the azepine ring adopts a boat conformation and the dihedral angle between the benzene rings fused to it is 57.95 (8)°. The bond-angle sum at the azepine N atom is 346.6°, indicating a significant deviation from planarity. The triazole ring subtends a dihedral angle of 71.45 (10)° with the terminal phenyl group. A weak intra-molecular C-H⋯Na (a = azepine) inter-action occurs, which closes an S(6) ring. ...[more]

PMID: 24109324

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