Structure and adsorption properties of a porous cooper hexacyanoferrate polymorph

The key questions addressed here were: the structure elucidation and the investigation of the adsorption space and framework expansion effect of a Cu(II) hexacyanoferrate (III) polymorph (labeled Cu-PBA-I). The structural analysis was performed with a broad set of characterization methods. Additionally, a low and high pressure carbon dioxide adsorption investigation was performed, assuming, to comprehend the adsorption experiments, that the adsorbent plus the adsorbed phase were a solid solution. We concluded: that the Cu-PBA-I presented the following composition, K1/4Cu(II)[Fe(III)(CN)6]3/4⋄1/4nH2O, exhibited an antiferromagnetic behavior and displayed a thermally stable I4¯m2 space group lattice in the degassed state. Moreover, the low pressure adsorption study allowed the calculation of the micropore volume, W=0.09cm3/g and the isosteric heat of adsorption, qiso=19kJ/mol; further, the high pressure adsorption data revealed an extremely high adsorption capacity owing to a framework expansion effect. Finally, the DRIFTS spectrum of adsorbed CO2 displayed peaks corresponding to carbon dioxide physically adsorbed and interacting with electron accepting Lewis acid sites. Hence, was produced an excellent adsorbent which combine porosity and anti-ferromagnetism, antagonist properties rarely found together. [Display omitted] •Was synthesized and characterized the standard Cu(II) hexacyanoferrate.•Was elucidated the structure of the synthesized Cu(II) hexacyanoferrate (III) polymorph (labeled Cu-PBA-II).•Were studied the adsorption properties of the produced Cu-PBA-II.•The produced Cu-PBA-II exhibited exceptional adsorption properties.•The Cu-PBA-II combines porosity and anti-ferromagnetism.