3-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1H-1,2,4-triazole-5(4H)-thione
In the title compound, C26H37N5S, the piperazine ring adopts a chair conformation with the exocyclic N—C bonds in pseudo-equatorial orientations. The piperazine ring (all atoms) subtends dihedral angles of 79.47 (9) and 73.07 (9)° with the triazole and benzene...
| Main Authors: | , , , , |
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| Format: | Article |
| Language: | English |
| Published: |
International Union of Crystallography
2013-12-01
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| Series: | Acta Crystallographica Section E |
| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S1600536813031127 |
| _version_ | 1819107200569704448 |
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| author | Hoong-Kun Fun C. S. Chidan Kumar Ali A. El-Emam Hanaa M. Al-Tuwaijri Ebtehal S. Al-Abdullah |
| author_facet | Hoong-Kun Fun C. S. Chidan Kumar Ali A. El-Emam Hanaa M. Al-Tuwaijri Ebtehal S. Al-Abdullah |
| author_sort | Hoong-Kun Fun |
| collection | DOAJ |
| description | In the title compound, C26H37N5S, the piperazine ring adopts a chair conformation with the exocyclic N—C bonds in pseudo-equatorial orientations. The piperazine ring (all atoms) subtends dihedral angles of 79.47 (9) and 73.07 (9)° with the triazole and benzene rings, respectively, resulting in an approximate U-shape for the molecule. No significant intermolecular interactions are observed in the crystal. |
| first_indexed | 2024-12-22T02:50:15Z |
| format | Article |
| id | doaj.art-b61bbd5ddc8d47f7a1b01570c6e534cf |
| institution | Directory Open Access Journal |
| issn | 1600-5368 |
| language | English |
| last_indexed | 2024-12-22T02:50:15Z |
| publishDate | 2013-12-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | Acta Crystallographica Section E |
| spelling | doaj.art-b61bbd5ddc8d47f7a1b01570c6e534cf2022-12-21T18:41:24ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682013-12-016912o1813o181410.1107/S16005368130311273-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1H-1,2,4-triazole-5(4H)-thioneHoong-Kun FunC. S. Chidan KumarAli A. El-EmamHanaa M. Al-TuwaijriEbtehal S. Al-AbdullahIn the title compound, C26H37N5S, the piperazine ring adopts a chair conformation with the exocyclic N—C bonds in pseudo-equatorial orientations. The piperazine ring (all atoms) subtends dihedral angles of 79.47 (9) and 73.07 (9)° with the triazole and benzene rings, respectively, resulting in an approximate U-shape for the molecule. No significant intermolecular interactions are observed in the crystal.http://scripts.iucr.org/cgi-bin/paper?S1600536813031127 |
| spellingShingle | Hoong-Kun Fun C. S. Chidan Kumar Ali A. El-Emam Hanaa M. Al-Tuwaijri Ebtehal S. Al-Abdullah 3-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1H-1,2,4-triazole-5(4H)-thione Acta Crystallographica Section E |
| title | 3-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_full | 3-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_fullStr | 3-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_full_unstemmed | 3-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_short | 3-(Adamantan-1-yl)-1-[(4-benzylpiperazin-1-yl)methyl]-4-ethyl-1H-1,2,4-triazole-5(4H)-thione |
| title_sort | 3 adamantan 1 yl 1 4 benzylpiperazin 1 yl methyl 4 ethyl 1h 1 2 4 triazole 5 4h thione |
| url | http://scripts.iucr.org/cgi-bin/paper?S1600536813031127 |
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