3-(2-Oxo-2,3,4,5-tetra­hydro­furan-3-yl)-1-benzofuran-2-carbonitrile

The asymmetric unit of the title compound, C(13)H(9)NO(3), consists of two crystallographically independent mol­ecules. In each mol­ecule, the tetra­hydro­furan (THF) ring adopts an envelope conformation with one of the methyl­ene C atoms positioned at the flap. The dihedral angles between the mean...

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Detalles Bibliográficos
Autores principales: Okuda, Kensuke, Hirota, Takashi, Nishina, Yuta, Ishida, Hiroyuki
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/PMC3435843/
https://www.ncbi.nlm.nih.gov/pubmed/22969689
http://dx.doi.org/10.1107/S1600536812036835
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author Okuda, Kensuke
Hirota, Takashi
Nishina, Yuta
Ishida, Hiroyuki
author_facet Okuda, Kensuke
Hirota, Takashi
Nishina, Yuta
Ishida, Hiroyuki
author_sort Okuda, Kensuke
collection PubMed
description The asymmetric unit of the title compound, C(13)H(9)NO(3), consists of two crystallographically independent mol­ecules. In each mol­ecule, the tetra­hydro­furan (THF) ring adopts an envelope conformation with one of the methyl­ene C atoms positioned at the flap. The dihedral angles between the mean plane of the THF and the benzofuran ring system are 70.85 (5) and 89.59 (6)°. In the crystal, mol­ecules are stacked in a column along the a-axis direction through C—H⋯O hydrogen bonds, with columns further linked by C—H⋯N and C—H⋯O inter­actions.
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spelling pubmed-34358432012-09-11 3-(2-Oxo-2,3,4,5-tetra­hydro­furan-3-yl)-1-benzofuran-2-carbonitrile Okuda, Kensuke Hirota, Takashi Nishina, Yuta Ishida, Hiroyuki Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(13)H(9)NO(3), consists of two crystallographically independent mol­ecules. In each mol­ecule, the tetra­hydro­furan (THF) ring adopts an envelope conformation with one of the methyl­ene C atoms positioned at the flap. The dihedral angles between the mean plane of the THF and the benzofuran ring system are 70.85 (5) and 89.59 (6)°. In the crystal, mol­ecules are stacked in a column along the a-axis direction through C—H⋯O hydrogen bonds, with columns further linked by C—H⋯N and C—H⋯O inter­actions. International Union of Crystallography 2012-08-31 /pmc/articles/PMC3435843/ /pubmed/22969689 http://dx.doi.org/10.1107/S1600536812036835 Text en © Okuda 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
Okuda, Kensuke
Hirota, Takashi
Nishina, Yuta
Ishida, Hiroyuki
3-(2-Oxo-2,3,4,5-tetra­hydro­furan-3-yl)-1-benzofuran-2-carbonitrile
title 3-(2-Oxo-2,3,4,5-tetra­hydro­furan-3-yl)-1-benzofuran-2-carbonitrile
title_full 3-(2-Oxo-2,3,4,5-tetra­hydro­furan-3-yl)-1-benzofuran-2-carbonitrile
title_fullStr 3-(2-Oxo-2,3,4,5-tetra­hydro­furan-3-yl)-1-benzofuran-2-carbonitrile
title_full_unstemmed 3-(2-Oxo-2,3,4,5-tetra­hydro­furan-3-yl)-1-benzofuran-2-carbonitrile
title_short 3-(2-Oxo-2,3,4,5-tetra­hydro­furan-3-yl)-1-benzofuran-2-carbonitrile
title_sort 3-(2-oxo-2,3,4,5-tetra­hydro­furan-3-yl)-1-benzofuran-2-carbonitrile
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3435843/
https://www.ncbi.nlm.nih.gov/pubmed/22969689
http://dx.doi.org/10.1107/S1600536812036835
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