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Oxonium picrate

The title compound, H(3)O(+)·C(6)H(2)N(3)O(7) (−), consists of one picrate anion and one oxonium cation. The oxonium cation is located on a crystallographic twofold axis and both its H atoms are disordered, each over two symmetry-equivalent positions with occupancy ratios of 0.75. The picrate anions...

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Detalles Bibliográficos
Autores principales: Jin, Shou-Wen, Chen, Bing-Xia, Ge, Yu-Shuang, Yin, Hua-Bing, Fang, Yu-Ping
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3151795/
https://www.ncbi.nlm.nih.gov/pubmed/21837091
http://dx.doi.org/10.1107/S1600536811022574
Descripción
Sumario:The title compound, H(3)O(+)·C(6)H(2)N(3)O(7) (−), consists of one picrate anion and one oxonium cation. The oxonium cation is located on a crystallographic twofold axis and both its H atoms are disordered, each over two symmetry-equivalent positions with occupancy ratios of 0.75. The picrate anions are also located on twofold axes bis­ecting the phenolate and p-nitro groups. π–π inter­actions between the rings of the picrates [centroid-to-centroid distances of 3.324 (2) Å] connect the anions to form stacks along the a-axis direction. The stacks are further joined together by the protonated water mol­ecules through hydrogen bonds to form two-dimensional sheets extending parallel to the ab plane. The sheets are stacked on top of each other along the c-axis direction and connected through C—H⋯O inter­actions between the CH groups of the benzene rings and the picrate nitro groups, with C⋯O distances of 3.450 (2) Å.