CaCuBi is hexagonal omega structure-derived structured and crystallizes in the hexagonal P6_3/mmc space group. Ca(1) is bonded to six equivalent Cu(1) and six equivalent Bi(1) atoms to form a mixture of edge and face-sharing CaCu6Bi6 cuboctahedra. Cu(1) is bonded in a 9-coordinate geometry to six equivalent Ca(1) and three equivalent Bi(1) atoms. Bi(1) is bonded in a 9-coordinate geometry to six equivalent Ca(1) and three equivalent Cu(1) atoms.
CaCuBi is hexagonal omega structure-derived structured and crystallizes in the hexagonal P6_3/mmc space group. Ca(1) is bonded to six equivalent Cu(1) and six equivalent Bi(1) atoms to form a mixture of edge and face-sharing CaCu6Bi6 cuboctahedra. All Ca(1)-Cu(1) bond lengths are 3.38 Å. All Ca(1)-Bi(1) bond lengths are 3.38 Å. Cu(1) is bonded in a 9-coordinate geometry to six equivalent Ca(1) and three equivalent Bi(1) atoms. All Cu(1)-Bi(1) bond lengths are 2.66 Å. Bi(1) is bonded in a 9-coordinate geometry to six equivalent Ca(1) and three equivalent Cu(1) atoms.