N-[4-Acetyl-5-(4-fluoro­phen­yl)-4,5-di­hydro-1,3,4-thia­diazol-2-yl]acetamide

The title mol­ecule, C(12)H(12)FN(3)O(2)S, shows a short intra­molecular S⋯O contact of 2.682 (18) Å. The dihedral angle between the thia­diazole ring and the benzene ring is 86.82 (11)°. In the crystal, N—H⋯O and C—H⋯O hydrogen bonds generate an R (2) (1)(6) graph-set motif between adjacent mol­ecu...

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Autores principales: Kavitha, H. D., Marganakop, Sheetal B., Kamble, Ravindra R., Roopashree, K. R., Devarajegowda, H. C.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3648237/
https://www.ncbi.nlm.nih.gov/pubmed/23723857
http://dx.doi.org/10.1107/S1600536813009367
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author Kavitha, H. D.
Marganakop, Sheetal B.
Kamble, Ravindra R.
Roopashree, K. R.
Devarajegowda, H. C.
author_facet Kavitha, H. D.
Marganakop, Sheetal B.
Kamble, Ravindra R.
Roopashree, K. R.
Devarajegowda, H. C.
author_sort Kavitha, H. D.
collection PubMed
description The title mol­ecule, C(12)H(12)FN(3)O(2)S, shows a short intra­molecular S⋯O contact of 2.682 (18) Å. The dihedral angle between the thia­diazole ring and the benzene ring is 86.82 (11)°. In the crystal, N—H⋯O and C—H⋯O hydrogen bonds generate an R (2) (1)(6) graph-set motif between adjacent mol­ecules. Pairs of futher C—H⋯O hydrogen bonds form inversion dimers with R (2) (2)(8) ring motifs. These combine to generate a three-dimensional network and stack the mol­ecules along the b axis.
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spelling pubmed-36482372013-05-30 N-[4-Acetyl-5-(4-fluoro­phen­yl)-4,5-di­hydro-1,3,4-thia­diazol-2-yl]acetamide Kavitha, H. D. Marganakop, Sheetal B. Kamble, Ravindra R. Roopashree, K. R. Devarajegowda, H. C. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title mol­ecule, C(12)H(12)FN(3)O(2)S, shows a short intra­molecular S⋯O contact of 2.682 (18) Å. The dihedral angle between the thia­diazole ring and the benzene ring is 86.82 (11)°. In the crystal, N—H⋯O and C—H⋯O hydrogen bonds generate an R (2) (1)(6) graph-set motif between adjacent mol­ecules. Pairs of futher C—H⋯O hydrogen bonds form inversion dimers with R (2) (2)(8) ring motifs. These combine to generate a three-dimensional network and stack the mol­ecules along the b axis. International Union of Crystallography 2013-04-13 /pmc/articles/PMC3648237/ /pubmed/23723857 http://dx.doi.org/10.1107/S1600536813009367 Text en © Kavitha et al. 2013 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
Kavitha, H. D.
Marganakop, Sheetal B.
Kamble, Ravindra R.
Roopashree, K. R.
Devarajegowda, H. C.
N-[4-Acetyl-5-(4-fluoro­phen­yl)-4,5-di­hydro-1,3,4-thia­diazol-2-yl]acetamide
title N-[4-Acetyl-5-(4-fluoro­phen­yl)-4,5-di­hydro-1,3,4-thia­diazol-2-yl]acetamide
title_full N-[4-Acetyl-5-(4-fluoro­phen­yl)-4,5-di­hydro-1,3,4-thia­diazol-2-yl]acetamide
title_fullStr N-[4-Acetyl-5-(4-fluoro­phen­yl)-4,5-di­hydro-1,3,4-thia­diazol-2-yl]acetamide
title_full_unstemmed N-[4-Acetyl-5-(4-fluoro­phen­yl)-4,5-di­hydro-1,3,4-thia­diazol-2-yl]acetamide
title_short N-[4-Acetyl-5-(4-fluoro­phen­yl)-4,5-di­hydro-1,3,4-thia­diazol-2-yl]acetamide
title_sort n-[4-acetyl-5-(4-fluoro­phen­yl)-4,5-di­hydro-1,3,4-thia­diazol-2-yl]acetamide
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3648237/
https://www.ncbi.nlm.nih.gov/pubmed/23723857
http://dx.doi.org/10.1107/S1600536813009367
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AT roopashreekr n4acetyl54fluorophenyl45dihydro134thiadiazol2ylacetamide
AT devarajegowdahc n4acetyl54fluorophenyl45dihydro134thiadiazol2ylacetamide

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