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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′...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2022
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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 |
Sumario: | 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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