Direct-space structure solution from laboratory powder diffraction data of an organic cocrystal: 1,2,3-trihydroxybenzene–HMTA (1/1)Electronic supplementary information (ESI) available: atomic coordinates and metrical parameters for 1,2,3-trihydroxybenzene–HMTA (1/1). See http://www.rsc.org/suppdata/cc/b0/b007189g/

Abstract

The crystal structure of an organic cocrystal, 1,2,3-trihydroxybenzene–hexamethylenetetramine (1/1), has been solved from conventional laboratory X-ray powder diffraction data that are significantly affected by preferred orientation, using a direct space structure solution approach based on the Monte Carlo method.