CuZrF6 crystallizes in the trigonal R-3 space group. Zr(1) is bonded to six equivalent F(1) atoms to form ZrF6 octahedra that share corners with six equivalent Cu(1)F6 octahedra. The corner-sharing octahedral tilt angles are 32°. Cu(1) is bonded to six equivalent F(1) atoms to form CuF6 octahedra that share corners with six equivalent Zr(1)F6 octahedra. The corner-sharing octahedral tilt angles are 32°. F(1) is bonded in a bent 150 degrees geometry to one Zr(1) and one Cu(1) atom.
CuZrF6 crystallizes in the trigonal R-3 space group. Zr(1) is bonded to six equivalent F(1) atoms to form ZrF6 octahedra that share corners with six equivalent Cu(1)F6 octahedra. The corner-sharing octahedral tilt angles are 32°. All Zr(1)-F(1) bond lengths are 2.02 Å. Cu(1) is bonded to six equivalent F(1) atoms to form CuF6 octahedra that share corners with six equivalent Zr(1)F6 octahedra. The corner-sharing octahedral tilt angles are 32°. All Cu(1)-F(1) bond lengths are 2.00 Å. F(1) is bonded in a bent 150 degrees geometry to one Zr(1) and one Cu(1) atom.