Crystal Structure of 4-({(1E,2E)-3-[3-(4-fluorophenyl)-1- isopropyl-1H-indol-2-yl]allylidene}amino)-5-methyl-1H-1,2,4-triazole-5(4H)-thione
The title compound, C23H22FN5S, exists in a trans conformation with respect to the methene C C and the acyclic N C bonds. The 1,2,4-triazole-5(4H)-thione ring makes dihedral angles of 88.66 (9) and 84.51 (10)�, respectively, with the indole and benzene rings. In the crystal, molecules are linked by...
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International Union of Crystallography
2015
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my.ump.umpir.127962018-01-31T03:31:19Z http://umpir.ump.edu.my/id/eprint/12796/ Crystal Structure of 4-({(1E,2E)-3-[3-(4-fluorophenyl)-1- isopropyl-1H-indol-2-yl]allylidene}amino)-5-methyl-1H-1,2,4-triazole-5(4H)-thione Kulkarni, Ajaykumar D. Lutfor, M. R. M. M., Yusoff Huey, Chong Kwong Ching, Kheng Quah QD Chemistry The title compound, C23H22FN5S, exists in a trans conformation with respect to the methene C C and the acyclic N C bonds. The 1,2,4-triazole-5(4H)-thione ring makes dihedral angles of 88.66 (9) and 84.51 (10)�, respectively, with the indole and benzene rings. In the crystal, molecules are linked by pairs of N—H� � �S hydrogen bonds, forming inversion dimers with an R2 2(8) ring motif. The dimers are linked via C—H� � �� interactions, forming chains along [110]. The chains are linked via �—� interactions involving inversion-related triazole rings [centroid–centroid distance = 3.4340 (13) A ˚ ], forming layers parallel to the ab plane. International Union of Crystallography 2015 Article PeerReviewed application/pdf en http://umpir.ump.edu.my/id/eprint/12796/1/sendreprint_LR-1.pdf application/pdf en http://umpir.ump.edu.my/id/eprint/12796/7/fist-2015-lutfor-Crystal%20Structure.pdf Kulkarni, Ajaykumar D. and Lutfor, M. R. and M. M., Yusoff and Huey, Chong Kwong and Ching, Kheng Quah (2015) Crystal Structure of 4-({(1E,2E)-3-[3-(4-fluorophenyl)-1- isopropyl-1H-indol-2-yl]allylidene}amino)-5-methyl-1H-1,2,4-triazole-5(4H)-thione. Acta Crystallographica Section E: Crystallographic Communications, E71 (11). pp. 1411-1413. ISSN 2056-9890 http://dx.doi.org/10.1107/S2056989015020101 DOI: 10.1107/S205698901502201X |
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QD Chemistry Kulkarni, Ajaykumar D. Lutfor, M. R. M. M., Yusoff Huey, Chong Kwong Ching, Kheng Quah Crystal Structure of 4-({(1E,2E)-3-[3-(4-fluorophenyl)-1- isopropyl-1H-indol-2-yl]allylidene}amino)-5-methyl-1H-1,2,4-triazole-5(4H)-thione |
| description |
The title compound, C23H22FN5S, exists in a trans conformation with respect to the methene C C and the acyclic N C bonds. The 1,2,4-triazole-5(4H)-thione
ring makes dihedral angles of 88.66 (9) and 84.51 (10)�, respectively, with the indole and benzene rings. In the crystal, molecules are linked by pairs of N—H� � �S hydrogen bonds, forming inversion dimers with an R2 2(8) ring motif. The dimers are linked via C—H� � �� interactions, forming chains along [110]. The chains are linked via �—� interactions involving inversion-related triazole rings
[centroid–centroid distance = 3.4340 (13) A ˚ ], forming layers parallel to the ab plane. |
| format |
Article |
| author |
Kulkarni, Ajaykumar D. Lutfor, M. R. M. M., Yusoff Huey, Chong Kwong Ching, Kheng Quah |
| author_facet |
Kulkarni, Ajaykumar D. Lutfor, M. R. M. M., Yusoff Huey, Chong Kwong Ching, Kheng Quah |
| author_sort |
Kulkarni, Ajaykumar D. |
| title |
Crystal Structure of 4-({(1E,2E)-3-[3-(4-fluorophenyl)-1-
isopropyl-1H-indol-2-yl]allylidene}amino)-5-methyl-1H-1,2,4-triazole-5(4H)-thione |
| title_short |
Crystal Structure of 4-({(1E,2E)-3-[3-(4-fluorophenyl)-1-
isopropyl-1H-indol-2-yl]allylidene}amino)-5-methyl-1H-1,2,4-triazole-5(4H)-thione |
| title_full |
Crystal Structure of 4-({(1E,2E)-3-[3-(4-fluorophenyl)-1-
isopropyl-1H-indol-2-yl]allylidene}amino)-5-methyl-1H-1,2,4-triazole-5(4H)-thione |
| title_fullStr |
Crystal Structure of 4-({(1E,2E)-3-[3-(4-fluorophenyl)-1-
isopropyl-1H-indol-2-yl]allylidene}amino)-5-methyl-1H-1,2,4-triazole-5(4H)-thione |
| title_full_unstemmed |
Crystal Structure of 4-({(1E,2E)-3-[3-(4-fluorophenyl)-1-
isopropyl-1H-indol-2-yl]allylidene}amino)-5-methyl-1H-1,2,4-triazole-5(4H)-thione |
| title_sort |
crystal structure of 4-({(1e,2e)-3-[3-(4-fluorophenyl)-1-
isopropyl-1h-indol-2-yl]allylidene}amino)-5-methyl-1h-1,2,4-triazole-5(4h)-thione |
| publisher |
International Union of Crystallography |
| publishDate |
2015 |
| url |
http://umpir.ump.edu.my/id/eprint/12796/1/sendreprint_LR-1.pdf http://umpir.ump.edu.my/id/eprint/12796/7/fist-2015-lutfor-Crystal%20Structure.pdf http://umpir.ump.edu.my/id/eprint/12796/ http://dx.doi.org/10.1107/S2056989015020101 |
| _version_ |
1643666993003364352 |