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6-Eth­oxy­carbonyl-5,7-dihy­droxy-2,3-dihydro-1H-pyrido[3,2,1-ij]quinolinium tribromide

In the title salt, C(15)H(16)NO(4) (+.)Br(3) (−), classical intra­molecular O—H⋯O hydrogen bonds are found, which results in the co-planarity of the ester substituents with the quinolinium residue [C—C—C—O torsion angle = 1.0 (10)°]. The bromine anions are placed on both sides of heterocyclic cation...

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Detalles Bibliográficos
Autores principales: Rybakov, Victor B., Shishkina, Svitlana V., Ukrainets, Igor V., Golik, Nikolai Yu., Chernenok, Igor N.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3588293/
https://www.ncbi.nlm.nih.gov/pubmed/23476464
http://dx.doi.org/10.1107/S1600536812049276
Descripción
Sumario:In the title salt, C(15)H(16)NO(4) (+.)Br(3) (−), classical intra­molecular O—H⋯O hydrogen bonds are found, which results in the co-planarity of the ester substituents with the quinolinium residue [C—C—C—O torsion angle = 1.0 (10)°]. The bromine anions are placed on both sides of heterocyclic cation and form Br⋯N contacts of 3.674 (9) and 3.860 (9) Å, which confirms the location of positive charge on the N atom. Non-classical inter­molecular C—H⋯Br inter­actions stabilize the three-dimensional crystal structure. Moreover, anion⋯π inter­actions are noted [Br⋯ring centroid range = 3.367 (9)–3.697 (9) Å]. The partly saturated heterocycle is disordered over two sofa conformations with occupancies in the ratio 0.56 (2):0.44 (2).