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The structure of CaBa2(HPO4)2(H2PO4)2 consists of infinite [Ca(HPO4)2(H2PO4)2] anionic chains, built up from CaO6, HPO4 and H2PO4 polyhedra linked via Ca-O-P bonds. These chains are held together by nine-coordinate Ba2+ cations. A two-dimensional network of hydrogen bonds contributes to the linkage of these chains.

Supporting information

cif

Crystallographic Information File (CIF)
Contains datablock psi

hkl

Structure factor file (CIF format)
Contains datablock psi

-1
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