CCDC no.: 1580444A part of the polmeric title crystal structure is shown in the figure. (The asymmetric unit is labelled only. ′ = x, 0.5 − y, Tables 1 and 2 contain details on crystal structure and measurement conditions and a list of the atoms including atomic coordinates and displacement parameters.
Source of materialA mixture of 5-bromoisophthalic acid (BripH 2 , 24.5 mg, 0.1 mmol), Co(OAc) 2 ·2H 2 O (24 mg, 0.1 mmol), and 1,2-bis(imidazol-1-yl)ethane (bia, 16.2 mg, 0.1 mmol), were added to water (9 mL) and [BMI]Br (BMI = 1-butyl-3-methylimidazolium, 1 mL) in a 25 mL Teflon-lined autoclave. The mixture was heated at 413 K for 3 days and then slowly cooled down to room temperature. Pink block crystals of the title compound were obtained.
Experimental detailsThe hydrogen atoms were placed in calculated positions and refined using a riding on attached atoms with isotropic thermal parameters 1.2 times those of their carrier atoms. The U iso values of the hydrogen atoms of methyl groups and oxygen were set to 1.5U eq (C, O).