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2-(1H-Benzotriazol-1-yl)-1-(furan-2-yl)ethanol

2-(1H-Benzotriazol-1-yl)-1-(furan-2-yl)ethanol
2-(1H-Benzotriazol-1-yl)-1-(furan-2-yl)ethanol
In the title compound, C12H11N3O2, the benzotriazole ring system is approximately planar [maximum deviation = 0.008 (1) angstrom] and its mean plane is oriented at a dihedral angle of 24.05 (4)degrees with respect to the furan ring. In the crystal, O-H center dot center dot center dot N hydrogen bonds link the molecules into chains along the ac diagonal. pi-pi stacking between the furan rings, between the triazole and benzene rings, and between the benzene rings [centroid-centroid distances = 3.724 (1), 3.786 (1) and 3.8623 (9) A] are also observed.
o72
Özel Güven, Ö.
05f31a79-d1c9-4ec1-8e02-cf1221f90c15
Bayraktar, M.
7388f6f3-7848-4459-badb-29aff4f4dd63
Coles, S.J.
3116f58b-c30c-48cf-bdd5-397d1c1fecf8
Hökelek, T.
636afa71-725e-48fc-9e90-d4e77064c314
Özel Güven, Ö.
05f31a79-d1c9-4ec1-8e02-cf1221f90c15
Bayraktar, M.
7388f6f3-7848-4459-badb-29aff4f4dd63
Coles, S.J.
3116f58b-c30c-48cf-bdd5-397d1c1fecf8
Hökelek, T.
636afa71-725e-48fc-9e90-d4e77064c314

Özel Güven, Ö., Bayraktar, M., Coles, S.J. and Hökelek, T. (2012) 2-(1H-Benzotriazol-1-yl)-1-(furan-2-yl)ethanol. Acta Crystallographica Section E: Structure Reports Online, 68 (1), o72. (doi:10.1107/s1600536811051798).

Record type: Article

Abstract

In the title compound, C12H11N3O2, the benzotriazole ring system is approximately planar [maximum deviation = 0.008 (1) angstrom] and its mean plane is oriented at a dihedral angle of 24.05 (4)degrees with respect to the furan ring. In the crystal, O-H center dot center dot center dot N hydrogen bonds link the molecules into chains along the ac diagonal. pi-pi stacking between the furan rings, between the triazole and benzene rings, and between the benzene rings [centroid-centroid distances = 3.724 (1), 3.786 (1) and 3.8623 (9) A] are also observed.

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Published date: January 2012
Organisations: Chemistry, Faculty of Natural and Environmental Sciences, Organic Chemistry: Synthesis, Catalysis and Flow

Identifiers

Local EPrints ID: 345983
URI: http://eprints.soton.ac.uk/id/eprint/345983
PURE UUID: fbe266a8-e476-41d3-9757-8e4be86c87d6
ORCID for S.J. Coles: ORCID iD orcid.org/0000-0001-8414-9272

Catalogue record

Date deposited: 11 Dec 2012 10:06
Last modified: 18 Feb 2021 16:53

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Contributors

Author: Ö. Özel Güven
Author: M. Bayraktar
Author: S.J. Coles ORCID iD
Author: T. Hökelek

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