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1-Benzyl-1H-benzotriazole.

ABSTRACT: In the title compound, C(13)H(11)N(3), the benzotriazole ring system is essentially planar, with a maximum deviation of 0.0173?(18)?Å, and forms a dihedral angle of 75.08?(8)Å with the phenyl ring. In the crystal, pairs of weak C-H?N hydrogen bonds form inversion dimers. In addition, there are weak C-H??(arene) inter-actions and weak ?-? stacking inter-actions, with a centroid-centroid distance of 3.673?(11)?Å.

SUBMITTER: Selvarathy Grace P

PROVIDER: S-EPMC3344078 | biostudies-literature | 2012 Apr

REPOSITORIES: biostudies-literature

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1-Benzyl-1H-benzotriazole.

Selvarathy Grace P P Jebas Samuel Robinson SR Ravindran Durai Nayagam B B Schollmeyer Dieter D

Acta crystallographica. Section E, Structure reports online 20120321 Pt 4

In the title compound, C(13)H(11)N(3), the benzotriazole ring system is essentially planar, with a maximum deviation of 0.0173 (18) Å, and forms a dihedral angle of 75.08 (8)Å with the phenyl ring. In the crystal, pairs of weak C-H⋯N hydrogen bonds form inversion dimers. In addition, there are weak C-H⋯π(arene) inter-actions and weak π-π stacking inter-actions, with a centroid-centroid distance of 3.673 (11) Å. ...[more]

PMID: 22589987

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