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Ethane-1,2-diaminium dipicrate dihydrate

The title compound, C(2)H(10)N(2) (2+)·2C(6)H(2)N(3)O(7) (−)·2H(2)O, crystallizes with a complete picrate anion and half an ethyl­enediammonium dication on a mirror plane, and two half-water mol­ecules (both on a mirror plane) in the asymmetric unit. The N atoms from separate half ethyl­enediammoniu...

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Autores principales: Jasinski, Jerry P., Butcher, Ray J., Hakim Al-arique, Q. N. M., Yathirajan, H. S., Narayana, B.
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3052063/
https://www.ncbi.nlm.nih.gov/pubmed/21522391
http://dx.doi.org/10.1107/S1600536811004855
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author Jasinski, Jerry P.
Butcher, Ray J.
Hakim Al-arique, Q. N. M.
Yathirajan, H. S.
Narayana, B.
author_facet Jasinski, Jerry P.
Butcher, Ray J.
Hakim Al-arique, Q. N. M.
Yathirajan, H. S.
Narayana, B.
author_sort Jasinski, Jerry P.
collection PubMed
description The title compound, C(2)H(10)N(2) (2+)·2C(6)H(2)N(3)O(7) (−)·2H(2)O, crystallizes with a complete picrate anion and half an ethyl­enediammonium dication on a mirror plane, and two half-water mol­ecules (both on a mirror plane) in the asymmetric unit. The N atoms from separate half ethyl­enediammonium dications are in near proximity to a phenolate O atom and two o-NO(2) groups from the picrate anion, which, along with the water mol­ecule form N—H⋯O, O—H⋯O and weak intermolecular C—H⋯O hydrogen bonds that create cyclic patterns with graph-set descriptors R (2) (4)(8), R (4) (4)(12), and R (4) (4)(16). The crystal packing is strongly influenced by these inter­molecular inter­actions between symmetry-related water mol­ecules, the half ethyl­enediammonium dication and the picrate anion, forming a three-dimensional supermolecular structure.
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spelling pubmed-30520632011-04-26 Ethane-1,2-diaminium dipicrate dihydrate Jasinski, Jerry P. Butcher, Ray J. Hakim Al-arique, Q. N. M. Yathirajan, H. S. Narayana, B. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(2)H(10)N(2) (2+)·2C(6)H(2)N(3)O(7) (−)·2H(2)O, crystallizes with a complete picrate anion and half an ethyl­enediammonium dication on a mirror plane, and two half-water mol­ecules (both on a mirror plane) in the asymmetric unit. The N atoms from separate half ethyl­enediammonium dications are in near proximity to a phenolate O atom and two o-NO(2) groups from the picrate anion, which, along with the water mol­ecule form N—H⋯O, O—H⋯O and weak intermolecular C—H⋯O hydrogen bonds that create cyclic patterns with graph-set descriptors R (2) (4)(8), R (4) (4)(12), and R (4) (4)(16). The crystal packing is strongly influenced by these inter­molecular inter­actions between symmetry-related water mol­ecules, the half ethyl­enediammonium dication and the picrate anion, forming a three-dimensional supermolecular structure. International Union of Crystallography 2011-02-16 /pmc/articles/PMC3052063/ /pubmed/21522391 http://dx.doi.org/10.1107/S1600536811004855 Text en © Jasinski et al. 2011 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
Jasinski, Jerry P.
Butcher, Ray J.
Hakim Al-arique, Q. N. M.
Yathirajan, H. S.
Narayana, B.
Ethane-1,2-diaminium dipicrate dihydrate
title Ethane-1,2-diaminium dipicrate dihydrate
title_full Ethane-1,2-diaminium dipicrate dihydrate
title_fullStr Ethane-1,2-diaminium dipicrate dihydrate
title_full_unstemmed Ethane-1,2-diaminium dipicrate dihydrate
title_short Ethane-1,2-diaminium dipicrate dihydrate
title_sort ethane-1,2-diaminium dipicrate dihydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3052063/
https://www.ncbi.nlm.nih.gov/pubmed/21522391
http://dx.doi.org/10.1107/S1600536811004855
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AT yathirajanhs ethane12diaminiumdipicratedihydrate
AT narayanab ethane12diaminiumdipicratedihydrate