CaPdF4 crystallizes in the monoclinic P2_1/c space group. Ca(1) is bonded to two equivalent F(1) and four equivalent F(2) atoms to form distorted CaF6 octahedra that share corners with four equivalent Ca(1)F6 octahedra and corners with eight equivalent Pd(1)F6 octahedra. The corner-sharing octahedral tilt angles range from 57-64°. Pd(1) is bonded to two equivalent F(2) and four equivalent F(1) atoms to form PdF6 octahedra that share corners with four equivalent Pd(1)F6 octahedra and corners with eight equivalent Ca(1)F6 octahedra. The corner-sharing octahedral tilt angles range from 57-64°. There are two inequivalent F sites. In the first F site, F(1) is bonded in a trigonal planar geometry to one Ca(1) and two equivalent Pd(1) atoms. In the second F site, F(2) is bonded in a trigonal planar geometry to two equivalent Ca(1) and one Pd(1) atom.
CaPdF4 crystallizes in the monoclinic P2_1/c space group. Ca(1) is bonded to two equivalent F(1) and four equivalent F(2) atoms to form distorted CaF6 octahedra that share corners with four equivalent Ca(1)F6 octahedra and corners with eight equivalent Pd(1)F6 octahedra. The corner-sharing octahedral tilt angles range from 57-64°. Both Ca(1)-F(1) bond lengths are 2.35 Å. There are two shorter (2.26 Å) and two longer (2.29 Å) Ca(1)-F(2) bond lengths. Pd(1) is bonded to two equivalent F(2) and four equivalent F(1) atoms to form PdF6 octahedra that share corners with four equivalent Pd(1)F6 octahedra and corners with eight equivalent Ca(1)F6 octahedra. The corner-sharing octahedral tilt angles range from 57-64°. Both Pd(1)-F(2) bond lengths are 2.19 Å. There are two shorter (2.24 Å) and two longer (2.25 Å) Pd(1)-F(1) bond lengths. There are two inequivalent F sites. In the first F site, F(1) is bonded in a trigonal planar geometry to one Ca(1) and two equivalent Pd(1) atoms. In the second F site, F(2) is bonded in a trigonal planar geometry to two equivalent Ca(1) and one Pd(1) atom.