Acta Crystallographica Section E

Structure Reports Online

Volume 68, Part 1 (January 2012)

organic compounds

 

1-Hexyl-1,3,6,8-tetraazatricyclo[4.3.1.1^3,8]undecan-1-ium iodide

A. Rivera, J. Sadat-Bernal, J. Ríos-Motta, K. Fejfarová and M. Dusek

Abstract: In the title compound, C₁₃H₂₇N₄⁺·I^-, the ethylene bridge is distorted from the ideal D_2d symmetry wherein an N-C-C-N planar bridge, around whose C-C bond the C-N and C-H bonds are exactly eclipsed, is disordered over two sites with equal occupancies. In both disorder components, the hexyl chain adopts an ideal all-trans conformation. In the crystal, adjacent ions are connected by C-HI hydrogen bonds, forming ionic pairs that are further linked into chains along [101] via a second C-HI interaction.

	Hyper-Text Markup Language (HTML) file (68.7 kbytes) [ doi:10.1107/S1600536811050781/bx2384sup0.html ] Supplementary materials
	Chemical Markup Language (CML) file (6.1 kbytes) [ doi:10.1107/S1600536811050781/bx2384Isup3.cml ] Supplementary material

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