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Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine at 90 K

Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine, C(17)H(17)N(3)O(3), (I) and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine, C(17)H(17)BrN(2)O, (II) are described. Compounds I and II crystallize in the ortho­rhom­bic and monoclinic crystal systems with space groups Pna2(1) (Z′...

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Autores principales: Archana, Sreeramapura D., Kiran Kumar, Haruvegowda, Shankara Prasad, Holehundi J., Yathirajan, Hemmige S., Parkin, Sean
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9535836/
https://www.ncbi.nlm.nih.gov/pubmed/36250114
http://dx.doi.org/10.1107/S2056989022009008
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author Archana, Sreeramapura D.
Kiran Kumar, Haruvegowda
Shankara Prasad, Holehundi J.
Yathirajan, Hemmige S.
Parkin, Sean
author_facet Archana, Sreeramapura D.
Kiran Kumar, Haruvegowda
Shankara Prasad, Holehundi J.
Yathirajan, Hemmige S.
Parkin, Sean
author_sort Archana, Sreeramapura D.
collection PubMed
description Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine, C(17)H(17)N(3)O(3), (I) and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine, C(17)H(17)BrN(2)O, (II) are described. Compounds I and II crystallize in the ortho­rhom­bic and monoclinic crystal systems with space groups Pna2(1) (Z′ = 2, I) and P2(1) (Z′ = 1, II), respectively. The crystal of II was a two-component aggregate, treated as a ‘twin’ for data-acquisition purposes. There are no conventional hydrogen bonds in either I or II, but there are weaker C—H⋯O contacts. Each mol­ecule consists of a central piperazine ring in a chair conformation, with either benzoyl and nitro­phenyl (I) or 4-bromo­benzoyl and phenyl (II) groups attached to different nitro­gen atoms of the piperazine. The various atom–atom contact coverages as qu­anti­fied by Hirshfeld surface analysis fingerprint plots are given.
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spelling pubmed-95358362022-10-13 Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine at 90 K Archana, Sreeramapura D. Kiran Kumar, Haruvegowda Shankara Prasad, Holehundi J. Yathirajan, Hemmige S. Parkin, Sean Acta Crystallogr E Crystallogr Commun Research Communications Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine, C(17)H(17)N(3)O(3), (I) and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine, C(17)H(17)BrN(2)O, (II) are described. Compounds I and II crystallize in the ortho­rhom­bic and monoclinic crystal systems with space groups Pna2(1) (Z′ = 2, I) and P2(1) (Z′ = 1, II), respectively. The crystal of II was a two-component aggregate, treated as a ‘twin’ for data-acquisition purposes. There are no conventional hydrogen bonds in either I or II, but there are weaker C—H⋯O contacts. Each mol­ecule consists of a central piperazine ring in a chair conformation, with either benzoyl and nitro­phenyl (I) or 4-bromo­benzoyl and phenyl (II) groups attached to different nitro­gen atoms of the piperazine. The various atom–atom contact coverages as qu­anti­fied by Hirshfeld surface analysis fingerprint plots are given. International Union of Crystallography 2022-09-22 /pmc/articles/PMC9535836/ /pubmed/36250114 http://dx.doi.org/10.1107/S2056989022009008 Text en © Archana et al. 2022 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 Research Communications
Archana, Sreeramapura D.
Kiran Kumar, Haruvegowda
Shankara Prasad, Holehundi J.
Yathirajan, Hemmige S.
Parkin, Sean
Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine at 90 K
title Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine at 90 K
title_full Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine at 90 K
title_fullStr Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine at 90 K
title_full_unstemmed Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine at 90 K
title_short Synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine at 90 K
title_sort synthesis and crystal structures of 1-benzoyl-4-(4-nitro­phen­yl)piperazine and 1-(4-bromo­benzo­yl)-4-phenyl­piperazine at 90 k
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9535836/
https://www.ncbi.nlm.nih.gov/pubmed/36250114
http://dx.doi.org/10.1107/S2056989022009008
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