(E)-9-(But-2-en-1-yl)-6-chloro-9H-purine

Acta Crystallogr Sect E Struct Rep Online. 2013 May 11;69(Pt 6):o849. doi: 10.1107/S1600536813010416. Print 2013 Jun 1.

Abstract

The asymmetric unit of the title compound, C9H9ClN4, contains two mol-ecules. In the crystal, the mol-ecules are ordered in a chain-like fashion along the a axis, and form layers offset relative to the C plane by approximately 30°. This ordering does not, however, appear to be directed by classical hydrogen bonding.The allylic side chains of both independent mol-ecules are disordered, with occupancies of 0.870 (4) and 0.934 (3) for the major components. The disorder components represent two possible spatial orientations of the atoms around the C=C double bond.