KVMoO6 crystallizes in the orthorhombic Pnma space group. K(1) is bonded in a 8-coordinate geometry to one O(4), two equivalent O(1), two equivalent O(3), and three equivalent O(2) atoms. V(1) is bonded in a 6-coordinate geometry to one O(1), one O(3), one O(6), and three equivalent O(5) atoms. Mo(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(4), one O(5), and two equivalent O(6) atoms. There are six inequivalent O sites. In the first O site, O(6) is bonded in a distorted trigonal non-coplanar geometry to one V(1) and two equivalent Mo(1) atoms. In the second O site, O(1) is bonded in a distorted single-bond geometry to two equivalent K(1), one V(1), and one Mo(1) atom. In the third O site, O(2) is bonded in a distorted single-bond geometry to three equivalent K(1) and one Mo(1) atom. In the fourth O site, O(3) is bonded in a distorted single-bond geometry to two equivalent K(1) and one V(1) atom. In the fifth O site, O(4) is bonded in a 2-coordinate geometry to one K(1) and one Mo(1) atom. In the sixth O site, O(5) is bonded in a 4-coordinate geometry to three equivalent V(1) and one Mo(1) atom.
KVMoO6 crystallizes in the orthorhombic Pnma space group. K(1) is bonded in a 8-coordinate geometry to one O(4), two equivalent O(1), two equivalent O(3), and three equivalent O(2) atoms. The K(1)-O(4) bond length is 2.73 Å. Both K(1)-O(1) bond lengths are 3.03 Å. Both K(1)-O(3) bond lengths are 2.90 Å. All K(1)-O(2) bond lengths are 2.92 Å. V(1) is bonded in a 6-coordinate geometry to one O(1), one O(3), one O(6), and three equivalent O(5) atoms. The V(1)-O(1) bond length is 1.71 Å. The V(1)-O(3) bond length is 1.65 Å. The V(1)-O(6) bond length is 2.18 Å. There are two shorter (1.98 Å) and one longer (2.54 Å) V(1)-O(5) bond length. Mo(1) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(4), one O(5), and two equivalent O(6) atoms. The Mo(1)-O(1) bond length is 2.35 Å. The Mo(1)-O(2) bond length is 1.75 Å. The Mo(1)-O(4) bond length is 1.73 Å. The Mo(1)-O(5) bond length is 2.20 Å. Both Mo(1)-O(6) bond lengths are 1.97 Å. There are six inequivalent O sites. In the first O site, O(6) is bonded in a distorted trigonal non-coplanar geometry to one V(1) and two equivalent Mo(1) atoms. In the second O site, O(1) is bonded in a distorted single-bond geometry to two equivalent K(1), one V(1), and one Mo(1) atom. In the third O site, O(2) is bonded in a distorted single-bond geometry to three equivalent K(1) and one Mo(1) atom. In the fourth O site, O(3) is bonded in a distorted single-bond geometry to two equivalent K(1) and one V(1) atom. In the fifth O site, O(4) is bonded in a 2-coordinate geometry to one K(1) and one Mo(1) atom. In the sixth O site, O(5) is bonded in a 4-coordinate geometry to three equivalent V(1) and one Mo(1) atom.