1-Benzyl-1H-benzotriazole 3-oxide–1-hy­droxy-1H-benzotriazole (1/1)

In the title compound, C(6)H(5)N(3)O·C(13)H(11)N(3)O, the benzo­triazole ring system in the 1-benzyl-1H-benzotriazole 3-oxide (A) mol­ecule is close to being planar (r.m.s. deviation = 0.011 Å); its mean plane forms a dihedral angle of 67.56 (7)° with that of the attached phenyl ring. The benzotriaz...

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Autores principales: Selvarathy Grace, P., Jebas, Samuel Robinson, Ravindran Durai Nayagam, B., Schollmeyer, Dieter
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414323/
https://www.ncbi.nlm.nih.gov/pubmed/22904856
http://dx.doi.org/10.1107/S1600536812030061
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author Selvarathy Grace, P.
Jebas, Samuel Robinson
Ravindran Durai Nayagam, B.
Schollmeyer, Dieter
author_facet Selvarathy Grace, P.
Jebas, Samuel Robinson
Ravindran Durai Nayagam, B.
Schollmeyer, Dieter
author_sort Selvarathy Grace, P.
collection PubMed
description In the title compound, C(6)H(5)N(3)O·C(13)H(11)N(3)O, the benzo­triazole ring system in the 1-benzyl-1H-benzotriazole 3-oxide (A) mol­ecule is close to being planar (r.m.s. deviation = 0.011 Å); its mean plane forms a dihedral angle of 67.56 (7)° with that of the attached phenyl ring. The benzotriazole ring system in the 1-hy­droxy­benzotriazole (B) mol­ecule is also close to being planar (r.m.s. deviation = 0.010 Å). In the crystal, weak C—H⋯O and C—H⋯π inter­actions are present. The A and B molecules are linked by an O—H⋯N hydrogen bond.
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spelling pubmed-34143232012-08-17 1-Benzyl-1H-benzotriazole 3-oxide–1-hy­droxy-1H-benzotriazole (1/1) Selvarathy Grace, P. Jebas, Samuel Robinson Ravindran Durai Nayagam, B. Schollmeyer, Dieter Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(6)H(5)N(3)O·C(13)H(11)N(3)O, the benzo­triazole ring system in the 1-benzyl-1H-benzotriazole 3-oxide (A) mol­ecule is close to being planar (r.m.s. deviation = 0.011 Å); its mean plane forms a dihedral angle of 67.56 (7)° with that of the attached phenyl ring. The benzotriazole ring system in the 1-hy­droxy­benzotriazole (B) mol­ecule is also close to being planar (r.m.s. deviation = 0.010 Å). In the crystal, weak C—H⋯O and C—H⋯π inter­actions are present. The A and B molecules are linked by an O—H⋯N hydrogen bond. International Union of Crystallography 2012-07-10 /pmc/articles/PMC3414323/ /pubmed/22904856 http://dx.doi.org/10.1107/S1600536812030061 Text en © Selvarathy Grace et al. 2012 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Selvarathy Grace, P.
Jebas, Samuel Robinson
Ravindran Durai Nayagam, B.
Schollmeyer, Dieter
1-Benzyl-1H-benzotriazole 3-oxide–1-hy­droxy-1H-benzotriazole (1/1)
title 1-Benzyl-1H-benzotriazole 3-oxide–1-hy­droxy-1H-benzotriazole (1/1)
title_full 1-Benzyl-1H-benzotriazole 3-oxide–1-hy­droxy-1H-benzotriazole (1/1)
title_fullStr 1-Benzyl-1H-benzotriazole 3-oxide–1-hy­droxy-1H-benzotriazole (1/1)
title_full_unstemmed 1-Benzyl-1H-benzotriazole 3-oxide–1-hy­droxy-1H-benzotriazole (1/1)
title_short 1-Benzyl-1H-benzotriazole 3-oxide–1-hy­droxy-1H-benzotriazole (1/1)
title_sort 1-benzyl-1h-benzotriazole 3-oxide–1-hy­droxy-1h-benzotriazole (1/1)
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414323/
https://www.ncbi.nlm.nih.gov/pubmed/22904856
http://dx.doi.org/10.1107/S1600536812030061
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