Crystal Structure of (E)-2-(3,3,3-tri­fluoro­prop-1-en-1-yl)aniline

The mol­ecule of the title compound, C(9)H(8)F(3)N, adopts an E configuration with respect to the C=C double bond. The dihedral angle between the benzene ring and the prop-1-enyl group is 25.4 (3)°. In the crystal, mol­ecules are linked via pairs of N—H⋯F hydrogen bonds into inversion dimers with an...

Descripción completa

Detalles Bibliográficos
Autores principales: Kubono, Koji, Tani, Keita, Omote, Masaaki, Ogawa, Futa, Matsumoto, Taisuke
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2018
Materias:
Research Communications
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6176427/
https://www.ncbi.nlm.nih.gov/pubmed/30319798
http://dx.doi.org/10.1107/S2056989018012756
_version_ 1783361699696345088
author Kubono, Koji
Tani, Keita
Omote, Masaaki
Ogawa, Futa
Matsumoto, Taisuke
author_facet Kubono, Koji
Tani, Keita
Omote, Masaaki
Ogawa, Futa
Matsumoto, Taisuke
author_sort Kubono, Koji
collection PubMed
description The mol­ecule of the title compound, C(9)H(8)F(3)N, adopts an E configuration with respect to the C=C double bond. The dihedral angle between the benzene ring and the prop-1-enyl group is 25.4 (3)°. In the crystal, mol­ecules are linked via pairs of N—H⋯F hydrogen bonds into inversion dimers with an R (2) (2)(16) ring motif. The dimers are linked by C—H⋯N hydrogen bonds, forming a ribbon structure along the b-axis direction. The ribbons are linked by N—H⋯π and C—H⋯π inter­actions, generating a three-dimensional network.
format Online
Article
Text
id pubmed-6176427
institution National Center for Biotechnology Information
language English
publishDate 2018
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-61764272018-10-12 Crystal Structure of (E)-2-(3,3,3-tri­fluoro­prop-1-en-1-yl)aniline Kubono, Koji Tani, Keita Omote, Masaaki Ogawa, Futa Matsumoto, Taisuke Acta Crystallogr E Crystallogr Commun Research Communications The mol­ecule of the title compound, C(9)H(8)F(3)N, adopts an E configuration with respect to the C=C double bond. The dihedral angle between the benzene ring and the prop-1-enyl group is 25.4 (3)°. In the crystal, mol­ecules are linked via pairs of N—H⋯F hydrogen bonds into inversion dimers with an R (2) (2)(16) ring motif. The dimers are linked by C—H⋯N hydrogen bonds, forming a ribbon structure along the b-axis direction. The ribbons are linked by N—H⋯π and C—H⋯π inter­actions, generating a three-dimensional network. International Union of Crystallography 2018-09-18 /pmc/articles/PMC6176427/ /pubmed/30319798 http://dx.doi.org/10.1107/S2056989018012756 Text en © Kubono et al. 2018 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/
spellingShingle Research Communications
Kubono, Koji
Tani, Keita
Omote, Masaaki
Ogawa, Futa
Matsumoto, Taisuke
Crystal Structure of (E)-2-(3,3,3-tri­fluoro­prop-1-en-1-yl)aniline
title Crystal Structure of (E)-2-(3,3,3-tri­fluoro­prop-1-en-1-yl)aniline
title_full Crystal Structure of (E)-2-(3,3,3-tri­fluoro­prop-1-en-1-yl)aniline
title_fullStr Crystal Structure of (E)-2-(3,3,3-tri­fluoro­prop-1-en-1-yl)aniline
title_full_unstemmed Crystal Structure of (E)-2-(3,3,3-tri­fluoro­prop-1-en-1-yl)aniline
title_short Crystal Structure of (E)-2-(3,3,3-tri­fluoro­prop-1-en-1-yl)aniline
title_sort crystal structure of (e)-2-(3,3,3-tri­fluoro­prop-1-en-1-yl)aniline
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6176427/
https://www.ncbi.nlm.nih.gov/pubmed/30319798
http://dx.doi.org/10.1107/S2056989018012756
work_keys_str_mv AT kubonokoji crystalstructureofe2333trifluoroprop1en1ylaniline
AT tanikeita crystalstructureofe2333trifluoroprop1en1ylaniline
AT omotemasaaki crystalstructureofe2333trifluoroprop1en1ylaniline
AT ogawafuta crystalstructureofe2333trifluoroprop1en1ylaniline
AT matsumototaisuke crystalstructureofe2333trifluoroprop1en1ylaniline

Ejemplares similares