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4-Bromo-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylsulfamoyl}-5-methylbenzoic acid monohydrate
In the title compound, C(19)H(22)BrNO(6)S·H(2)O, the dihedral angle between the planes of the two benzene rings is 3.1 (1)°. These rings are stacked over one another with their centroids separated by 3.769 (2) Å, indicating weak π–π interactions. In the crystal structure, molecules are linked by O...
| Autores principales: | , , , , |
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| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2009
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969419/ https://www.ncbi.nlm.nih.gov/pubmed/21582848 http://dx.doi.org/10.1107/S1600536809022041 |
| _version_ | 1782190144691896320 |
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| author | Babu, C. Suneel Manohar Kavitha, Helen P. Vennila, Jasmine P. Chakkaravarthi, G. Manivannan, V. |
| author_facet | Babu, C. Suneel Manohar Kavitha, Helen P. Vennila, Jasmine P. Chakkaravarthi, G. Manivannan, V. |
| author_sort | Babu, C. Suneel Manohar |
| collection | PubMed |
| description | In the title compound, C(19)H(22)BrNO(6)S·H(2)O, the dihedral angle between the planes of the two benzene rings is 3.1 (1)°. These rings are stacked over one another with their centroids separated by 3.769 (2) Å, indicating weak π–π interactions. In the crystal structure, molecules are linked by O—H⋯O and O—H⋯(O,O) hydrogen bonds involving the water molecule, forming a two-dimensional network parallel to (001). |
| format | Text |
| id | pubmed-2969419 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2009 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-29694192010-12-30 4-Bromo-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylsulfamoyl}-5-methylbenzoic acid monohydrate Babu, C. Suneel Manohar Kavitha, Helen P. Vennila, Jasmine P. Chakkaravarthi, G. Manivannan, V. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(19)H(22)BrNO(6)S·H(2)O, the dihedral angle between the planes of the two benzene rings is 3.1 (1)°. These rings are stacked over one another with their centroids separated by 3.769 (2) Å, indicating weak π–π interactions. In the crystal structure, molecules are linked by O—H⋯O and O—H⋯(O,O) hydrogen bonds involving the water molecule, forming a two-dimensional network parallel to (001). International Union of Crystallography 2009-06-13 /pmc/articles/PMC2969419/ /pubmed/21582848 http://dx.doi.org/10.1107/S1600536809022041 Text en © Babu et al. 2009 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 Babu, C. Suneel Manohar Kavitha, Helen P. Vennila, Jasmine P. Chakkaravarthi, G. Manivannan, V. 4-Bromo-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylsulfamoyl}-5-methylbenzoic acid monohydrate |
| title | 4-Bromo-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylsulfamoyl}-5-methylbenzoic acid monohydrate |
| title_full | 4-Bromo-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylsulfamoyl}-5-methylbenzoic acid monohydrate |
| title_fullStr | 4-Bromo-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylsulfamoyl}-5-methylbenzoic acid monohydrate |
| title_full_unstemmed | 4-Bromo-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylsulfamoyl}-5-methylbenzoic acid monohydrate |
| title_short | 4-Bromo-3-{N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylsulfamoyl}-5-methylbenzoic acid monohydrate |
| title_sort | 4-bromo-3-{n-[2-(3,4-dimethoxyphenyl)ethyl]-n-methylsulfamoyl}-5-methylbenzoic acid monohydrate |
| topic | Organic Papers |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2969419/ https://www.ncbi.nlm.nih.gov/pubmed/21582848 http://dx.doi.org/10.1107/S1600536809022041 |
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