1-{(Z)-1-[3-(4-Bromophenoxy)propoxy]-1-(2,4-difluorophenyl)prop-1-en-2-yl}-1H-1,2,4-triazol-4-ium nitrate
In the title molecular salt, C20H19BrF2N3O2+·NO3−, the N atom at position 4 of the heterocyclic ring is protonated. The triazole ring makes dihedral angles of 96.6 (4) and 54.4 (3)° with the 4-bromophenyl and 2,4-difluorophenyl ring...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
International Union of Crystallography
2012-07-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536812024154 |
| _version_ | 1818959809867677696 |
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| author | Fei Shen Song Guo Yuan-yuan Luan Kai Wang Yong-hong Hu |
| author_facet | Fei Shen Song Guo Yuan-yuan Luan Kai Wang Yong-hong Hu |
| author_sort | Fei Shen |
| collection | DOAJ |
| description | In the title molecular salt, C20H19BrF2N3O2+·NO3−, the N atom at position 4 of the heterocyclic ring is protonated. The triazole ring makes dihedral angles of 96.6 (4) and 54.4 (3)° with the 4-bromophenyl and 2,4-difluorophenyl rings, respectively, and the molecule adopts a Z conformation about the C=C double bond. In the crystal, cations and anions are linked by N—H...O and C—H...O hydrogen bonds. |
| first_indexed | 2024-12-20T11:47:33Z |
| format | Article |
| id | doaj.art-89fa3b8ef0d5478bb66364ca83de3012 |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-20T11:47:33Z |
| publishDate | 2012-07-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-89fa3b8ef0d5478bb66364ca83de30122022-12-21T19:41:50ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682012-07-01687o2010o201010.1107/S16005368120241541-{(Z)-1-[3-(4-Bromophenoxy)propoxy]-1-(2,4-difluorophenyl)prop-1-en-2-yl}-1H-1,2,4-triazol-4-ium nitrateFei ShenSong GuoYuan-yuan LuanKai WangYong-hong HuIn the title molecular salt, C20H19BrF2N3O2+·NO3−, the N atom at position 4 of the heterocyclic ring is protonated. The triazole ring makes dihedral angles of 96.6 (4) and 54.4 (3)° with the 4-bromophenyl and 2,4-difluorophenyl rings, respectively, and the molecule adopts a Z conformation about the C=C double bond. In the crystal, cations and anions are linked by N—H...O and C—H...O hydrogen bonds.http://scripts.iucr.org/cgi-bin/paper?S1600536812024154 |
| spellingShingle | Fei Shen Song Guo Yuan-yuan Luan Kai Wang Yong-hong Hu 1-{(Z)-1-[3-(4-Bromophenoxy)propoxy]-1-(2,4-difluorophenyl)prop-1-en-2-yl}-1H-1,2,4-triazol-4-ium nitrate Acta Crystallographica Section E |
| title | 1-{(Z)-1-[3-(4-Bromophenoxy)propoxy]-1-(2,4-difluorophenyl)prop-1-en-2-yl}-1H-1,2,4-triazol-4-ium nitrate |
| title_full | 1-{(Z)-1-[3-(4-Bromophenoxy)propoxy]-1-(2,4-difluorophenyl)prop-1-en-2-yl}-1H-1,2,4-triazol-4-ium nitrate |
| title_fullStr | 1-{(Z)-1-[3-(4-Bromophenoxy)propoxy]-1-(2,4-difluorophenyl)prop-1-en-2-yl}-1H-1,2,4-triazol-4-ium nitrate |
| title_full_unstemmed | 1-{(Z)-1-[3-(4-Bromophenoxy)propoxy]-1-(2,4-difluorophenyl)prop-1-en-2-yl}-1H-1,2,4-triazol-4-ium nitrate |
| title_short | 1-{(Z)-1-[3-(4-Bromophenoxy)propoxy]-1-(2,4-difluorophenyl)prop-1-en-2-yl}-1H-1,2,4-triazol-4-ium nitrate |
| title_sort | 1 z 1 3 4 bromophenoxy propoxy 1 2 4 difluorophenyl prop 1 en 2 yl 1h 1 2 4 triazol 4 ium nitrate |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536812024154 |
| work_keys_str_mv | AT feishen 1z134bromophenoxypropoxy124difluorophenylprop1en2yl1h124triazol4iumnitrate AT songguo 1z134bromophenoxypropoxy124difluorophenylprop1en2yl1h124triazol4iumnitrate AT yuanyuanluan 1z134bromophenoxypropoxy124difluorophenylprop1en2yl1h124triazol4iumnitrate AT kaiwang 1z134bromophenoxypropoxy124difluorophenylprop1en2yl1h124triazol4iumnitrate AT yonghonghu 1z134bromophenoxypropoxy124difluorophenylprop1en2yl1h124triazol4iumnitrate |