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Crystal structure of poly[[di-μ(2)-aqua-aqua­sodium] 4-amino-3,5,6-tri­chloro­pyridine-2-carboxyl­ate trihydrate], the sodium salt of the herbicide picloram

In the structure of the title complex, {[Na(H(2)O)(3)](C(6)H(2)Cl(3)N(2)O(2))·3H(2)O}(n), the sodium salt of the herbicide picloram, the cation adopts a polymeric chain structure, based on μ(2)-aqua-bridged NaO(5) trigonal–bipyramidal complex units which have, in addition, a singly bonded water mol­...

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Detalles Bibliográficos
Autor principal: Smith, Graham
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4571359/
https://www.ncbi.nlm.nih.gov/pubmed/26396758
http://dx.doi.org/10.1107/S2056989015012633
Descripción
Sumario:In the structure of the title complex, {[Na(H(2)O)(3)](C(6)H(2)Cl(3)N(2)O(2))·3H(2)O}(n), the sodium salt of the herbicide picloram, the cation adopts a polymeric chain structure, based on μ(2)-aqua-bridged NaO(5) trigonal–bipyramidal complex units which have, in addition, a singly bonded water mol­ecule. Each of the bridges within the chain, which extends parallel to the a axis, is centrosymmetric, with Na⋯Na separations of 3.4807 (16) and 3.5109 (16) Å. In the crystal, there are three water mol­ecules of solvation and these, as well as the coordinating water mol­ecules and the amino group of the 4-amino-3,5,6-tri­chloro­picolinate anion, are involved in extensive inter-species hydrogen-bonding inter­actions with carboxyl and water O atoms, as well as the pyridine N atom. Among these associations is a centrosymmetric cyclic tetra­water R (4) (4)(8) motif, resulting in an overall three-dimensional structure.