LaMoCrZnO6 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic Pc space group. La(1) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(3), one O(6), two equivalent O(4), and two equivalent O(5) atoms. Mo(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form MoO6 octahedra that share corners with six equivalent Cr(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-41°. Cr(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form CrO6 octahedra that share corners with six equivalent Mo(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-41°. Zn(1) is bonded in a 3-coordinate geometry to one O(4), one O(5), and one O(6) atom. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one La(1), one Mo(1), and one Cr(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one La(1), one Mo(1), and one Cr(1) atom. In the third O site, O(3) is bonded in a distorted trigonal non-coplanar geometry to one La(1), one Mo(1), and one Cr(1) atom. In the fourth O site, O(4) is bonded in a 5-coordinate geometry to two equivalent La(1), one Mo(1), one Cr(1), and one Zn(1) atom. In the fifth O site, O(5) is bonded in a 5-coordinate geometry to two equivalent La(1), one Mo(1), one Cr(1), and one Zn(1) atom. In the sixth O site, O(6) is bonded in a distorted tetrahedral geometry to one La(1), one Mo(1), one Cr(1), and one Zn(1) atom.
LaMoCrZnO6 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic Pc space group. La(1) is bonded in a 8-coordinate geometry to one O(1), one O(2), one O(3), one O(6), two equivalent O(4), and two equivalent O(5) atoms. The La(1)-O(1) bond length is 2.32 Å. The La(1)-O(2) bond length is 2.36 Å. The La(1)-O(3) bond length is 2.34 Å. The La(1)-O(6) bond length is 2.50 Å. There is one shorter (2.71 Å) and one longer (2.81 Å) La(1)-O(4) bond length. There is one shorter (2.68 Å) and one longer (2.85 Å) La(1)-O(5) bond length. Mo(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form MoO6 octahedra that share corners with six equivalent Cr(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-41°. The Mo(1)-O(1) bond length is 2.11 Å. The Mo(1)-O(2) bond length is 2.00 Å. The Mo(1)-O(3) bond length is 1.99 Å. The Mo(1)-O(4) bond length is 2.09 Å. The Mo(1)-O(5) bond length is 2.12 Å. The Mo(1)-O(6) bond length is 2.17 Å. Cr(1) is bonded to one O(1), one O(2), one O(3), one O(4), one O(5), and one O(6) atom to form CrO6 octahedra that share corners with six equivalent Mo(1)O6 octahedra. The corner-sharing octahedral tilt angles range from 31-41°. The Cr(1)-O(1) bond length is 2.02 Å. The Cr(1)-O(2) bond length is 1.98 Å. The Cr(1)-O(3) bond length is 1.98 Å. The Cr(1)-O(4) bond length is 2.09 Å. The Cr(1)-O(5) bond length is 2.08 Å. The Cr(1)-O(6) bond length is 2.10 Å. Zn(1) is bonded in a 3-coordinate geometry to one O(4), one O(5), and one O(6) atom. The Zn(1)-O(4) bond length is 2.11 Å. The Zn(1)-O(5) bond length is 2.10 Å. The Zn(1)-O(6) bond length is 2.02 Å. There are six inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one La(1), one Mo(1), and one Cr(1) atom. In the second O site, O(2) is bonded in a 3-coordinate geometry to one La(1), one Mo(1), and one Cr(1) atom. In the third O site, O(3) is bonded in a distorted trigonal non-coplanar geometry to one La(1), one Mo(1), and one Cr(1) atom. In the fourth O site, O(4) is bonded in a 5-coordinate geometry to two equivalent La(1), one Mo(1), one Cr(1), and one Zn(1) atom. In the fifth O site, O(5) is bonded in a 5-coordinate geometry to two equivalent La(1), one Mo(1), one Cr(1), and one Zn(1) atom. In the sixth O site, O(6) is bonded in a distorted tetrahedral geometry to one La(1), one Mo(1), one Cr(1), and one Zn(1) atom.