Acta Crystallographica Section E

Structure Reports Online

Volume 68, Part 1 (January 2012)


organic compounds



bx2384 scheme

Acta Cryst. (2012). E68, o17    [ doi:10.1107/S1600536811050781 ]

1-Hexyl-1,3,6,8-tetraazatricyclo[4.3.1.13,8]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 D2d 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-H...I hydrogen bonds, forming ionic pairs that are further linked into chains along [101] via a second C-H...I interaction.


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