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5,5′-[(1,4-Phenylenedimethylene)bis(sulfanediyl)]bis(1-methyl-1H-1,2,3,4-tetrazole)
The title molecule, C(12)H(14)N(8)S(2), has point symmetry [Image: see text] since it is situated on a crystallographic centre of symmetry. The 1-methyl/5-thio groups are in an antiperiplanar conformation. The dihedral angle between the benzene and tetrazole rings is 84.33 (2)°. In the crystal,...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
International Union of Crystallography
2011
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3247454/ https://www.ncbi.nlm.nih.gov/pubmed/22220072 http://dx.doi.org/10.1107/S1600536811043182 |
| _version_ | 1782220110863269888 |
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| author | He, Dan-Feng Deng, Jin-Jun Zhou, Fu-Jiang Liu, Hong-Sheng Wang, Li-Min |
| author_facet | He, Dan-Feng Deng, Jin-Jun Zhou, Fu-Jiang Liu, Hong-Sheng Wang, Li-Min |
| author_sort | He, Dan-Feng |
| collection | PubMed |
| description | The title molecule, C(12)H(14)N(8)S(2), has point symmetry [Image: see text] since it is situated on a crystallographic centre of symmetry. The 1-methyl/5-thio groups are in an antiperiplanar conformation. The dihedral angle between the benzene and tetrazole rings is 84.33 (2)°. In the crystal, C—H⋯N hydrogen bonds link molecules into ladder-like chains running along the b axis. There are also C—H⋯π interactions present in the crystal structure. |
| format | Online Article Text |
| id | pubmed-3247454 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2011 |
| publisher | International Union of Crystallography |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-32474542012-01-04 5,5′-[(1,4-Phenylenedimethylene)bis(sulfanediyl)]bis(1-methyl-1H-1,2,3,4-tetrazole) He, Dan-Feng Deng, Jin-Jun Zhou, Fu-Jiang Liu, Hong-Sheng Wang, Li-Min Acta Crystallogr Sect E Struct Rep Online Organic Papers The title molecule, C(12)H(14)N(8)S(2), has point symmetry [Image: see text] since it is situated on a crystallographic centre of symmetry. The 1-methyl/5-thio groups are in an antiperiplanar conformation. The dihedral angle between the benzene and tetrazole rings is 84.33 (2)°. In the crystal, C—H⋯N hydrogen bonds link molecules into ladder-like chains running along the b axis. There are also C—H⋯π interactions present in the crystal structure. International Union of Crystallography 2011-10-29 /pmc/articles/PMC3247454/ /pubmed/22220072 http://dx.doi.org/10.1107/S1600536811043182 Text en © He et al. 2011 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 He, Dan-Feng Deng, Jin-Jun Zhou, Fu-Jiang Liu, Hong-Sheng Wang, Li-Min 5,5′-[(1,4-Phenylenedimethylene)bis(sulfanediyl)]bis(1-methyl-1H-1,2,3,4-tetrazole) |
| title | 5,5′-[(1,4-Phenylenedimethylene)bis(sulfanediyl)]bis(1-methyl-1H-1,2,3,4-tetrazole) |
| title_full | 5,5′-[(1,4-Phenylenedimethylene)bis(sulfanediyl)]bis(1-methyl-1H-1,2,3,4-tetrazole) |
| title_fullStr | 5,5′-[(1,4-Phenylenedimethylene)bis(sulfanediyl)]bis(1-methyl-1H-1,2,3,4-tetrazole) |
| title_full_unstemmed | 5,5′-[(1,4-Phenylenedimethylene)bis(sulfanediyl)]bis(1-methyl-1H-1,2,3,4-tetrazole) |
| title_short | 5,5′-[(1,4-Phenylenedimethylene)bis(sulfanediyl)]bis(1-methyl-1H-1,2,3,4-tetrazole) |
| title_sort | 5,5′-[(1,4-phenylenedimethylene)bis(sulfanediyl)]bis(1-methyl-1h-1,2,3,4-tetrazole) |
| topic | Organic Papers |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3247454/ https://www.ncbi.nlm.nih.gov/pubmed/22220072 http://dx.doi.org/10.1107/S1600536811043182 |
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