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(2R,3R,4S,5R)-2-(4-Amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol
The molecular structure of the title compound, C(11)H(13)IN(4)O(3), shows a ribofuranosyl–pyrrolo O—C—N—C torsion angle of 59.1 (3)°, with the central C—N bond length being 1.446 (3) Å. The C—I bond length is 2.072 (2) Å. The amino group is coplanar with the attached aromatic ring [C—N—C—N torsio...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884313/ https://www.ncbi.nlm.nih.gov/pubmed/24454089 http://dx.doi.org/10.1107/S1600536813027931 |
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author | Flörke, Ulrich Drewes, Birte |
author_facet | Flörke, Ulrich Drewes, Birte |
author_sort | Flörke, Ulrich |
collection | PubMed |
description | The molecular structure of the title compound, C(11)H(13)IN(4)O(3), shows a ribofuranosyl–pyrrolo O—C—N—C torsion angle of 59.1 (3)°, with the central C—N bond length being 1.446 (3) Å. The C—I bond length is 2.072 (2) Å. The amino group is coplanar with the attached aromatic ring [C—N—C—N torsion angle = −178.8 (2)°] and forms an intramolecular N—H⋯I hydrogen bond. In the crystal, O—H⋯N and N—H⋯O hydrogen bonds link the molecules into puckered layers parallel to (001). These layers are bound to each other by secondary I⋯O interactions [3.2250 (17) Å], forming a three-dimensional framework. |
format | Online Article Text |
id | pubmed-3884313 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-38843132014-01-17 (2R,3R,4S,5R)-2-(4-Amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol Flörke, Ulrich Drewes, Birte Acta Crystallogr Sect E Struct Rep Online Organic Papers The molecular structure of the title compound, C(11)H(13)IN(4)O(3), shows a ribofuranosyl–pyrrolo O—C—N—C torsion angle of 59.1 (3)°, with the central C—N bond length being 1.446 (3) Å. The C—I bond length is 2.072 (2) Å. The amino group is coplanar with the attached aromatic ring [C—N—C—N torsion angle = −178.8 (2)°] and forms an intramolecular N—H⋯I hydrogen bond. In the crystal, O—H⋯N and N—H⋯O hydrogen bonds link the molecules into puckered layers parallel to (001). These layers are bound to each other by secondary I⋯O interactions [3.2250 (17) Å], forming a three-dimensional framework. International Union of Crystallography 2013-10-16 /pmc/articles/PMC3884313/ /pubmed/24454089 http://dx.doi.org/10.1107/S1600536813027931 Text en © Flörke and Drewes 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 Flörke, Ulrich Drewes, Birte (2R,3R,4S,5R)-2-(4-Amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol |
title | (2R,3R,4S,5R)-2-(4-Amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol |
title_full | (2R,3R,4S,5R)-2-(4-Amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol |
title_fullStr | (2R,3R,4S,5R)-2-(4-Amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol |
title_full_unstemmed | (2R,3R,4S,5R)-2-(4-Amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol |
title_short | (2R,3R,4S,5R)-2-(4-Amino-5-iodo-7H-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol |
title_sort | (2r,3r,4s,5r)-2-(4-amino-5-iodo-7h-pyrrolo[2,3-d]pyrimidin-7-yl)-5-methyltetrahydrofuran-3,4-diol |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884313/ https://www.ncbi.nlm.nih.gov/pubmed/24454089 http://dx.doi.org/10.1107/S1600536813027931 |
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