4-Benzyl-3-[(1-oxidoethylidene)amino]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-iminium

The title compound, C(17)H(17)N(5)O, exists in the zwitterionic form with the amide group deprotonated. The mean planes of the 1,2,4-triazole and N-phenyl rings form a dihedral angle of 39.14 (8)°. The N atom of the amino group adopts a trigonal configuration. Inter­moleculat C—H⋯O and C—H⋯N hydroge...

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Detalles Bibliográficos
Autores principales: Chernyshev, Victor M., Mazharova, Anna G., Rybakov, Victor B.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3100060/
https://www.ncbi.nlm.nih.gov/pubmed/21754149
http://dx.doi.org/10.1107/S1600536811006751
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author Chernyshev, Victor M.
Mazharova, Anna G.
Rybakov, Victor B.
author_facet Chernyshev, Victor M.
Mazharova, Anna G.
Rybakov, Victor B.
author_sort Chernyshev, Victor M.
collection PubMed
description The title compound, C(17)H(17)N(5)O, exists in the zwitterionic form with the amide group deprotonated. The mean planes of the 1,2,4-triazole and N-phenyl rings form a dihedral angle of 39.14 (8)°. The N atom of the amino group adopts a trigonal configuration. Inter­moleculat C—H⋯O and C—H⋯N hydrogen bonds occur. In the crystal, mol­ecules are linked into a two-dimensional network parallel to (10[Image: see text]) by N—H⋯O and N—H⋯N hydrogen bonds. C—H⋯N contacts are also observed.
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spelling pubmed-31000602011-07-13 4-Benzyl-3-[(1-oxidoethylidene)amino]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-iminium Chernyshev, Victor M. Mazharova, Anna G. Rybakov, Victor B. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(17)H(17)N(5)O, exists in the zwitterionic form with the amide group deprotonated. The mean planes of the 1,2,4-triazole and N-phenyl rings form a dihedral angle of 39.14 (8)°. The N atom of the amino group adopts a trigonal configuration. Inter­moleculat C—H⋯O and C—H⋯N hydrogen bonds occur. In the crystal, mol­ecules are linked into a two-dimensional network parallel to (10[Image: see text]) by N—H⋯O and N—H⋯N hydrogen bonds. C—H⋯N contacts are also observed. International Union of Crystallography 2011-03-12 /pmc/articles/PMC3100060/ /pubmed/21754149 http://dx.doi.org/10.1107/S1600536811006751 Text en © Chernyshev et al. 2011 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
Chernyshev, Victor M.
Mazharova, Anna G.
Rybakov, Victor B.
4-Benzyl-3-[(1-oxidoethylidene)amino]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-iminium
title 4-Benzyl-3-[(1-oxidoethylidene)amino]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-iminium
title_full 4-Benzyl-3-[(1-oxidoethylidene)amino]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-iminium
title_fullStr 4-Benzyl-3-[(1-oxidoethylidene)amino]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-iminium
title_full_unstemmed 4-Benzyl-3-[(1-oxidoethylidene)amino]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-iminium
title_short 4-Benzyl-3-[(1-oxidoethylidene)amino]-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-5-iminium
title_sort 4-benzyl-3-[(1-oxidoethylidene)amino]-1-phenyl-4,5-dihydro-1h-1,2,4-triazol-5-iminium
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3100060/
https://www.ncbi.nlm.nih.gov/pubmed/21754149
http://dx.doi.org/10.1107/S1600536811006751
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AT rybakovvictorb 4benzyl31oxidoethylideneamino1phenyl45dihydro1h124triazol5iminium

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