Ethyl 5-meth­oxy-2-trifluoro­methyl-1H-indole-3-carboxyl­ate

The title compound, C(13)H(12)F(3)NO(3), is almost planar if one excludes the F atoms of the –CF(3) group [maximum deviation for the other hetero atoms = 0.069 (1) Å], and the dihedral angle between the pyrrole and benzene ring of the indole system is 2.54 (8)°. In the crystal, mol­ecules are linked...

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Detalles Bibliográficos
Autores principales: Crochet, Aurelien, Alimi, Isak, Bochet, Christian G., Fromm, Katharina M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588460/
https://www.ncbi.nlm.nih.gov/pubmed/23476533
http://dx.doi.org/10.1107/S1600536813002614
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author Crochet, Aurelien
Alimi, Isak
Bochet, Christian G.
Fromm, Katharina M.
author_facet Crochet, Aurelien
Alimi, Isak
Bochet, Christian G.
Fromm, Katharina M.
author_sort Crochet, Aurelien
collection PubMed
description The title compound, C(13)H(12)F(3)NO(3), is almost planar if one excludes the F atoms of the –CF(3) group [maximum deviation for the other hetero atoms = 0.069 (1) Å], and the dihedral angle between the pyrrole and benzene ring of the indole system is 2.54 (8)°. In the crystal, mol­ecules are linked by N—H⋯O hydrogen bonds, forming chains propagating along the a-axis direction. These chains are linked via C—H⋯O and C—H⋯F hydrogen bonds, forming a three-dimensional network.
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spelling pubmed-35884602013-03-08 Ethyl 5-meth­oxy-2-trifluoro­methyl-1H-indole-3-carboxyl­ate Crochet, Aurelien Alimi, Isak Bochet, Christian G. Fromm, Katharina M. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(13)H(12)F(3)NO(3), is almost planar if one excludes the F atoms of the –CF(3) group [maximum deviation for the other hetero atoms = 0.069 (1) Å], and the dihedral angle between the pyrrole and benzene ring of the indole system is 2.54 (8)°. In the crystal, mol­ecules are linked by N—H⋯O hydrogen bonds, forming chains propagating along the a-axis direction. These chains are linked via C—H⋯O and C—H⋯F hydrogen bonds, forming a three-dimensional network. International Union of Crystallography 2013-02-02 /pmc/articles/PMC3588460/ /pubmed/23476533 http://dx.doi.org/10.1107/S1600536813002614 Text en © Crochet et al. 2013 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
Crochet, Aurelien
Alimi, Isak
Bochet, Christian G.
Fromm, Katharina M.
Ethyl 5-meth­oxy-2-trifluoro­methyl-1H-indole-3-carboxyl­ate
title Ethyl 5-meth­oxy-2-trifluoro­methyl-1H-indole-3-carboxyl­ate
title_full Ethyl 5-meth­oxy-2-trifluoro­methyl-1H-indole-3-carboxyl­ate
title_fullStr Ethyl 5-meth­oxy-2-trifluoro­methyl-1H-indole-3-carboxyl­ate
title_full_unstemmed Ethyl 5-meth­oxy-2-trifluoro­methyl-1H-indole-3-carboxyl­ate
title_short Ethyl 5-meth­oxy-2-trifluoro­methyl-1H-indole-3-carboxyl­ate
title_sort ethyl 5-meth­oxy-2-trifluoro­methyl-1h-indole-3-carboxyl­ate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588460/
https://www.ncbi.nlm.nih.gov/pubmed/23476533
http://dx.doi.org/10.1107/S1600536813002614
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AT alimiisak ethyl5methoxy2trifluoromethyl1hindole3carboxylate
AT bochetchristiang ethyl5methoxy2trifluoromethyl1hindole3carboxylate
AT frommkatharinam ethyl5methoxy2trifluoromethyl1hindole3carboxylate

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