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Crystal structure of 2-aza-niumyl-3-bromo-6-oxo-5,6-di-hydro-pyrido[1,2-a]quinoxalin-11-ium dibromide.


ABSTRACT: The title salt, C12H10BrN3O(2+)·2Br(-), was synthesized from the reaction of N (1),N (4)-bis-(pyridin-2-yl-methyl-idene)benzene-1,4-di-amine and bromine in a methanol solution. All non-H atoms of the 2-aza-niumyl-3-bromo-6-oxo-5,6-di-hydro-pyrido[1,2-a]quinoxalin-11-ium cation are nearly coplanar, the maximum deviation being 0.114?(4)?Å. In the crystal, the cations and anions are linked through N-H?Br hydrogen bonds and weak C-H?Br inter-actions, forming a three-dimensional supra-molecular architecture. A short Br?Br contact [3.3088?(9)?Å] is observed in the crystal.

SUBMITTER: Faizi MS 

PROVIDER: S-EPMC4331889 | biostudies-other | 2015 Jan

REPOSITORIES: biostudies-other

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Crystal structure of 2-aza-niumyl-3-bromo-6-oxo-5,6-di-hydro-pyrido[1,2-a]quinoxalin-11-ium dibromide.

Faizi Md Serajul Haque MS   Sharkina Natalia O NO   Iskenderov Turganbay S TS  

Acta crystallographica. Section E, Crystallographic communications 20150101 Pt 1


The title salt, C12H10BrN3O(2+)·2Br(-), was synthesized from the reaction of N (1),N (4)-bis-(pyridin-2-yl-methyl-idene)benzene-1,4-di-amine and bromine in a methanol solution. All non-H atoms of the 2-aza-niumyl-3-bromo-6-oxo-5,6-di-hydro-pyrido[1,2-a]quinoxalin-11-ium cation are nearly coplanar, the maximum deviation being 0.114 (4) Å. In the crystal, the cations and anions are linked through N-H⋯Br hydrogen bonds and weak C-H⋯Br inter-actions, forming a three-dimensional supra-molecular archi  ...[more]

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