Crystal Structure of New Zinc-Hydroxy-Sulfate-Hydrate Zn4(OH)6SO4·2–2.25H2O

A theoretical model of the crystal structure of the newly obtained compound Zn4(OH)6SO4·2–2.25H2O based on the compilation of the crystal–chemical properties of two known zinc-hydroxy-sulfate phases—mineral namuwite and hemihydrate—is proposed. The single XRD data confirmed the model and determined the structure, with a trigonal symmetry SG of P-3, the unit cell with a = 8.3418(15) Å and c = 17.595(7) Å, and a cell volume of 1060.3(6) Å3, with Z = 2. The results show that the Zn4(OH)6SO4·2–2.5H2O crystal structure consists of an alternating paired octahedral–tetrahedral doubly decorated hydroxide layer with cationic vacancies and an aqueous interlayer.