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Carbinoxaminium dipicrate.


ABSTRACT: In the dication of the title salt, C16H21ClN2O(2+)·2C6H2N3O7 (-) [systematic name: 2-{(4-chloro-phen-yl)[2-(di-methyl-aza-nium-yl)eth-oxy]meth-yl}pyridinium bis-(2,4,6-tri-nitro-phenolate), contains a carbinoxaminium dication and two picrate anions, which are held together through inter-molecular N-H?O hydrogen bonds. In the dication, the two aromatic rings form a dihedral angle of 80.1?(1)°. In the two independent picrate anions, the nitro groups are twisted from the benzene plane, the largest dihedral angle in each ion being 42.8?(1) and 81.1?(5)°. In the crystal, in addition to the classical N-H?O hydrogen bonds, weak C-H?O hydrogen bonds and ?-? inter-actions between the aromatic rings of the anions [centroid-centroid distances of 3.5768?(15) and 3.7436?(15)?Å] help to establish the packing.

SUBMITTER: Ramya V 

PROVIDER: S-EPMC3793761 | biostudies-literature | 2013

REPOSITORIES: biostudies-literature

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Carbinoxaminium dipicrate.

Ramya V V   Jasinski Jerry P JP   Shannon James P JP   Yathirajan H S HS   Ravishankara D K DK  

Acta crystallographica. Section E, Structure reports online 20130717 Pt 8


In the dication of the title salt, C16H21ClN2O(2+)·2C6H2N3O7 (-) [systematic name: 2-{(4-chloro-phen-yl)[2-(di-methyl-aza-nium-yl)eth-oxy]meth-yl}pyridinium bis-(2,4,6-tri-nitro-phenolate), contains a carbinoxaminium dication and two picrate anions, which are held together through inter-molecular N-H⋯O hydrogen bonds. In the dication, the two aromatic rings form a dihedral angle of 80.1 (1)°. In the two independent picrate anions, the nitro groups are twisted from the benzene plane, the largest  ...[more]

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