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5-Fluoro-1-(pentanoyl)pyrimidine-2,4(1H,3H)-dione
The pentanoyl group and the 5-fluorouracil moiety of the title compound, C(9)H(11)FN(2)O(3), are essentially coplanar, with the pentanoyl carbonyl group oriented towards the ring CH group and away from the nearer ring carbonyl group. In the crystal structure, two inversion-related molecules form...
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2008
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960789/ https://www.ncbi.nlm.nih.gov/pubmed/21201951 http://dx.doi.org/10.1107/S1600536808004418 |
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author | Lehmler, Hans-Joachim Parkin, Sean |
author_facet | Lehmler, Hans-Joachim Parkin, Sean |
author_sort | Lehmler, Hans-Joachim |
collection | PubMed |
description | The pentanoyl group and the 5-fluorouracil moiety of the title compound, C(9)H(11)FN(2)O(3), are essentially coplanar, with the pentanoyl carbonyl group oriented towards the ring CH group and away from the nearer ring carbonyl group. In the crystal structure, two inversion-related molecules form a dimer structure, in which two N—H⋯O hydrogen bonds generate an intermolecular R (2) (2)(8) ring. In addition, there are intra- and intermolecular C—H⋯O interactions. |
format | Text |
id | pubmed-2960789 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29607892010-12-30 5-Fluoro-1-(pentanoyl)pyrimidine-2,4(1H,3H)-dione Lehmler, Hans-Joachim Parkin, Sean Acta Crystallogr Sect E Struct Rep Online Organic Papers The pentanoyl group and the 5-fluorouracil moiety of the title compound, C(9)H(11)FN(2)O(3), are essentially coplanar, with the pentanoyl carbonyl group oriented towards the ring CH group and away from the nearer ring carbonyl group. In the crystal structure, two inversion-related molecules form a dimer structure, in which two N—H⋯O hydrogen bonds generate an intermolecular R (2) (2)(8) ring. In addition, there are intra- and intermolecular C—H⋯O interactions. International Union of Crystallography 2008-02-22 /pmc/articles/PMC2960789/ /pubmed/21201951 http://dx.doi.org/10.1107/S1600536808004418 Text en © Lehmler and Parkin 2008 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 Lehmler, Hans-Joachim Parkin, Sean 5-Fluoro-1-(pentanoyl)pyrimidine-2,4(1H,3H)-dione |
title | 5-Fluoro-1-(pentanoyl)pyrimidine-2,4(1H,3H)-dione |
title_full | 5-Fluoro-1-(pentanoyl)pyrimidine-2,4(1H,3H)-dione |
title_fullStr | 5-Fluoro-1-(pentanoyl)pyrimidine-2,4(1H,3H)-dione |
title_full_unstemmed | 5-Fluoro-1-(pentanoyl)pyrimidine-2,4(1H,3H)-dione |
title_short | 5-Fluoro-1-(pentanoyl)pyrimidine-2,4(1H,3H)-dione |
title_sort | 5-fluoro-1-(pentanoyl)pyrimidine-2,4(1h,3h)-dione |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2960789/ https://www.ncbi.nlm.nih.gov/pubmed/21201951 http://dx.doi.org/10.1107/S1600536808004418 |
work_keys_str_mv | AT lehmlerhansjoachim 5fluoro1pentanoylpyrimidine241h3hdione AT parkinsean 5fluoro1pentanoylpyrimidine241h3hdione |