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Bis[(3-chloro­benz­yl)ammonium] 2-phenyl­propane­dioate dihydrate

In the asymmetric unit of the title compound, 2C(7)H(9)ClN(+)·C(9)H(6)O(4) (2−)·2H(2)O, there are two crystallographically independent cations, one dianion and two water mol­ecules. The dihedral angle between the two carboxyl­ate groups of the dianion is 78.1 (2)°. In the crystal, the components are...

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Detalles Bibliográficos
Autores principales: Harrison, Jerry Joe Ebow Kingsley, Kingsford-Adaboh, Robert, Gotoh, Kazuma, Ishida, Hiroyuki
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007429/
https://www.ncbi.nlm.nih.gov/pubmed/21588449
http://dx.doi.org/10.1107/S1600536810029764
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author Harrison, Jerry Joe Ebow Kingsley
Kingsford-Adaboh, Robert
Gotoh, Kazuma
Ishida, Hiroyuki
author_facet Harrison, Jerry Joe Ebow Kingsley
Kingsford-Adaboh, Robert
Gotoh, Kazuma
Ishida, Hiroyuki
author_sort Harrison, Jerry Joe Ebow Kingsley
collection PubMed
description In the asymmetric unit of the title compound, 2C(7)H(9)ClN(+)·C(9)H(6)O(4) (2−)·2H(2)O, there are two crystallographically independent cations, one dianion and two water mol­ecules. The dihedral angle between the two carboxyl­ate groups of the dianion is 78.1 (2)°. In the crystal, the components are held together by N—H⋯O, O—H⋯O and C—H⋯O hydrogen bonds, forming a layer parallel to the bc plane, with the hydro­philic and hydro­phobic groups located in the inner and outer regions of the layers, respectively.
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spelling pubmed-30074292010-12-30 Bis[(3-chloro­benz­yl)ammonium] 2-phenyl­propane­dioate dihydrate Harrison, Jerry Joe Ebow Kingsley Kingsford-Adaboh, Robert Gotoh, Kazuma Ishida, Hiroyuki Acta Crystallogr Sect E Struct Rep Online Organic Papers In the asymmetric unit of the title compound, 2C(7)H(9)ClN(+)·C(9)H(6)O(4) (2−)·2H(2)O, there are two crystallographically independent cations, one dianion and two water mol­ecules. The dihedral angle between the two carboxyl­ate groups of the dianion is 78.1 (2)°. In the crystal, the components are held together by N—H⋯O, O—H⋯O and C—H⋯O hydrogen bonds, forming a layer parallel to the bc plane, with the hydro­philic and hydro­phobic groups located in the inner and outer regions of the layers, respectively. International Union of Crystallography 2010-07-31 /pmc/articles/PMC3007429/ /pubmed/21588449 http://dx.doi.org/10.1107/S1600536810029764 Text en © Harrison et al. 2010 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
Harrison, Jerry Joe Ebow Kingsley
Kingsford-Adaboh, Robert
Gotoh, Kazuma
Ishida, Hiroyuki
Bis[(3-chloro­benz­yl)ammonium] 2-phenyl­propane­dioate dihydrate
title Bis[(3-chloro­benz­yl)ammonium] 2-phenyl­propane­dioate dihydrate
title_full Bis[(3-chloro­benz­yl)ammonium] 2-phenyl­propane­dioate dihydrate
title_fullStr Bis[(3-chloro­benz­yl)ammonium] 2-phenyl­propane­dioate dihydrate
title_full_unstemmed Bis[(3-chloro­benz­yl)ammonium] 2-phenyl­propane­dioate dihydrate
title_short Bis[(3-chloro­benz­yl)ammonium] 2-phenyl­propane­dioate dihydrate
title_sort bis[(3-chloro­benz­yl)ammonium] 2-phenyl­propane­dioate dihydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007429/
https://www.ncbi.nlm.nih.gov/pubmed/21588449
http://dx.doi.org/10.1107/S1600536810029764
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