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2-[2-(1H-Imidazol-3-ium-5-yl)eth-yl]-3-(pyridin-2-yl)-2H-imidazo[1,5-a]pyridin-4-ium bis-(perchlorate).


ABSTRACT: In the title mol-ecular salt, C(17)H(17)N(5) (+)·2ClO(4) (-), the dihedral angles between the fused-ring system and the pendant five- and six-membered heterocyclic rings are 6.4?(2) and 41.29?(19)°, respectively. The O atoms of both perchlorate anions are disordered over two sets of sites with occupancy ratios of 0.614?(8):0.386?(8) and 0.591?(7):0.409?(7). An intra-molecular C-H?N contact occurs in the cation. In the crystal, the components are linked by N-H?O and C-H?O hydrogen bonds and ?-? stacking inter-actions [centroid-centroid separation = 3.642?(3)?Å].

SUBMITTER: Turky?lmaz M 

PROVIDER: S-EPMC3089310 | biostudies-literature | 2011 May

REPOSITORIES: biostudies-literature

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2-[2-(1H-Imidazol-3-ium-5-yl)eth-yl]-3-(pyridin-2-yl)-2H-imidazo[1,5-a]pyridin-4-ium bis-(perchlorate).

Türkyılmaz Murat M   Baran Yakup Y   Ozdemir Namık N  

Acta crystallographica. Section E, Structure reports online 20110429 Pt 5


In the title mol-ecular salt, C(17)H(17)N(5) (+)·2ClO(4) (-), the dihedral angles between the fused-ring system and the pendant five- and six-membered heterocyclic rings are 6.4 (2) and 41.29 (19)°, respectively. The O atoms of both perchlorate anions are disordered over two sets of sites with occupancy ratios of 0.614 (8):0.386 (8) and 0.591 (7):0.409 (7). An intra-molecular C-H⋯N contact occurs in the cation. In the crystal, the components are linked by N-H⋯O and C-H⋯O hydrogen bonds and π-π s  ...[more]

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