7-Chloro-3-(4-methyl­benzene­sulfon­yl)pyrrolo[1,2-c]pyrimidine

In the title compound, C(14)H(11)ClN(2)O(2)S, the dihedral angle between the pyrrolo­[1,2-c]pyrimidine ring system (r.m.s. deviation = 0.008 Å) and the benzene ring is 80.2 (9)°. In the crystal, inversion dimers linked by pairs of C—H⋯O inter­actions generate R (2) (2)(16) loops. Several aromatic π–...

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Autores principales: Narayan, Easha, Fu, Liangfeng, Gribble, Gordon W., Kaur, Manpreet, Jasinski, Jerry P.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2020
Materias:
Data Reports
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462199/
https://www.ncbi.nlm.nih.gov/pubmed/36339475
http://dx.doi.org/10.1107/S241431462000382X
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author Narayan, Easha
Fu, Liangfeng
Gribble, Gordon W.
Kaur, Manpreet
Jasinski, Jerry P.
author_facet Narayan, Easha
Fu, Liangfeng
Gribble, Gordon W.
Kaur, Manpreet
Jasinski, Jerry P.
author_sort Narayan, Easha
collection PubMed
description In the title compound, C(14)H(11)ClN(2)O(2)S, the dihedral angle between the pyrrolo­[1,2-c]pyrimidine ring system (r.m.s. deviation = 0.008 Å) and the benzene ring is 80.2 (9)°. In the crystal, inversion dimers linked by pairs of C—H⋯O inter­actions generate R (2) (2)(16) loops. Several aromatic π–π stacking inter­actions between the pyrrolo­[1,2-c]pyrimidine rings, as well as separately between the pyrrolo and pyrimidine groups [shortest centroid–centroid separation = 3.5758 (14) Å], help to consolidate the packing. [Image: see text]
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spelling pubmed-94621992022-11-04 7-Chloro-3-(4-methyl­benzene­sulfon­yl)pyrrolo[1,2-c]pyrimidine Narayan, Easha Fu, Liangfeng Gribble, Gordon W. Kaur, Manpreet Jasinski, Jerry P. IUCrdata Data Reports In the title compound, C(14)H(11)ClN(2)O(2)S, the dihedral angle between the pyrrolo­[1,2-c]pyrimidine ring system (r.m.s. deviation = 0.008 Å) and the benzene ring is 80.2 (9)°. In the crystal, inversion dimers linked by pairs of C—H⋯O inter­actions generate R (2) (2)(16) loops. Several aromatic π–π stacking inter­actions between the pyrrolo­[1,2-c]pyrimidine rings, as well as separately between the pyrrolo and pyrimidine groups [shortest centroid–centroid separation = 3.5758 (14) Å], help to consolidate the packing. [Image: see text] International Union of Crystallography 2020-03-27 /pmc/articles/PMC9462199/ /pubmed/36339475 http://dx.doi.org/10.1107/S241431462000382X Text en © Narayan et al. 2020 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Data Reports
Narayan, Easha
Fu, Liangfeng
Gribble, Gordon W.
Kaur, Manpreet
Jasinski, Jerry P.
7-Chloro-3-(4-methyl­benzene­sulfon­yl)pyrrolo[1,2-c]pyrimidine
title 7-Chloro-3-(4-methyl­benzene­sulfon­yl)pyrrolo[1,2-c]pyrimidine
title_full 7-Chloro-3-(4-methyl­benzene­sulfon­yl)pyrrolo[1,2-c]pyrimidine
title_fullStr 7-Chloro-3-(4-methyl­benzene­sulfon­yl)pyrrolo[1,2-c]pyrimidine
title_full_unstemmed 7-Chloro-3-(4-methyl­benzene­sulfon­yl)pyrrolo[1,2-c]pyrimidine
title_short 7-Chloro-3-(4-methyl­benzene­sulfon­yl)pyrrolo[1,2-c]pyrimidine
title_sort 7-chloro-3-(4-methyl­benzene­sulfon­yl)pyrrolo[1,2-c]pyrimidine
topic Data Reports
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462199/
https://www.ncbi.nlm.nih.gov/pubmed/36339475
http://dx.doi.org/10.1107/S241431462000382X
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