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4-Thiocarbamoylpyridin-1-ium iodide
The title salt, C(6)H(7)N(2)S(+)·I(−), crystallizes with two independent cations and two anions in the asymmetric unit. In one of the cations, the dihedral angle between the pyridinium ring and the thioamide group is 28.9 (2)°; in the other it is 33.5 (2)°. In the crystal, N—H⋯S and C—H⋯S hydrogen b...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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International Union of Crystallography
2014
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998408/ https://www.ncbi.nlm.nih.gov/pubmed/24765033 http://dx.doi.org/10.1107/S1600536814003511 |
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| author | Shotonwa, Ibukun O. Boeré, René T. |
| author_facet | Shotonwa, Ibukun O. Boeré, René T. |
| author_sort | Shotonwa, Ibukun O. |
| collection | PubMed |
| description | The title salt, C(6)H(7)N(2)S(+)·I(−), crystallizes with two independent cations and two anions in the asymmetric unit. In one of the cations, the dihedral angle between the pyridinium ring and the thioamide group is 28.9 (2)°; in the other it is 33.5 (2)°. In the crystal, N—H⋯S and C—H⋯S hydrogen bonds link the independent cations into pairs. These pairs form a three-dimensional network through additional N—H⋯I and C—H⋯I hydrogen bonds to the anions. |
| format | Online Article Text |
| id | pubmed-3998408 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2014 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-39984082014-04-24 4-Thiocarbamoylpyridin-1-ium iodide Shotonwa, Ibukun O. Boeré, René T. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title salt, C(6)H(7)N(2)S(+)·I(−), crystallizes with two independent cations and two anions in the asymmetric unit. In one of the cations, the dihedral angle between the pyridinium ring and the thioamide group is 28.9 (2)°; in the other it is 33.5 (2)°. In the crystal, N—H⋯S and C—H⋯S hydrogen bonds link the independent cations into pairs. These pairs form a three-dimensional network through additional N—H⋯I and C—H⋯I hydrogen bonds to the anions. International Union of Crystallography 2014-02-22 /pmc/articles/PMC3998408/ /pubmed/24765033 http://dx.doi.org/10.1107/S1600536814003511 Text en © Shotonwa and Boeré 2014 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 Shotonwa, Ibukun O. Boeré, René T. 4-Thiocarbamoylpyridin-1-ium iodide |
| title | 4-Thiocarbamoylpyridin-1-ium iodide |
| title_full | 4-Thiocarbamoylpyridin-1-ium iodide |
| title_fullStr | 4-Thiocarbamoylpyridin-1-ium iodide |
| title_full_unstemmed | 4-Thiocarbamoylpyridin-1-ium iodide |
| title_short | 4-Thiocarbamoylpyridin-1-ium iodide |
| title_sort | 4-thiocarbamoylpyridin-1-ium iodide |
| topic | Organic Papers |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998408/ https://www.ncbi.nlm.nih.gov/pubmed/24765033 http://dx.doi.org/10.1107/S1600536814003511 |
| work_keys_str_mv | AT shotonwaibukuno 4thiocarbamoylpyridin1iumiodide AT boererenet 4thiocarbamoylpyridin1iumiodide |