CsSbS(O2F)2 crystallizes in the orthorhombic Pna2_1 space group. Cs(1) is bonded in a 11-coordinate geometry to one O(1), one O(2), two equivalent O(3), two equivalent O(4), two equivalent F(2), and three equivalent F(1) atoms. Sb(1) is bonded in a distorted rectangular see-saw-like geometry to one O(2), one O(3), one F(1), and one F(2) atom. S(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one Cs(1) and one S(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Cs(1), one Sb(1), and one S(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to two equivalent Cs(1), one Sb(1), and one S(1) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to two equivalent Cs(1) and one S(1) atom. There are two inequivalent F sites. In the first F site, F(2) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one Sb(1) atom. In the second F site, F(1) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one Sb(1) atom.
CsSbS(O2F)2 crystallizes in the orthorhombic Pna2_1 space group. Cs(1) is bonded in a 11-coordinate geometry to one O(1), one O(2), two equivalent O(3), two equivalent O(4), two equivalent F(2), and three equivalent F(1) atoms. The Cs(1)-O(1) bond length is 3.09 Å. The Cs(1)-O(2) bond length is 3.55 Å. There is one shorter (3.31 Å) and one longer (3.44 Å) Cs(1)-O(3) bond length. There is one shorter (3.24 Å) and one longer (3.40 Å) Cs(1)-O(4) bond length. There is one shorter (3.05 Å) and one longer (3.25 Å) Cs(1)-F(2) bond length. There are a spread of Cs(1)-F(1) bond distances ranging from 3.01-3.37 Å. Sb(1) is bonded in a distorted rectangular see-saw-like geometry to one O(2), one O(3), one F(1), and one F(2) atom. The Sb(1)-O(2) bond length is 2.18 Å. The Sb(1)-O(3) bond length is 2.30 Å. The Sb(1)-F(1) bond length is 1.98 Å. The Sb(1)-F(2) bond length is 1.96 Å. S(1) is bonded in a tetrahedral geometry to one O(1), one O(2), one O(3), and one O(4) atom. The S(1)-O(1) bond length is 1.47 Å. The S(1)-O(2) bond length is 1.54 Å. The S(1)-O(3) bond length is 1.52 Å. The S(1)-O(4) bond length is 1.46 Å. There are four inequivalent O sites. In the first O site, O(1) is bonded in a single-bond geometry to one Cs(1) and one S(1) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Cs(1), one Sb(1), and one S(1) atom. In the third O site, O(3) is bonded in a 1-coordinate geometry to two equivalent Cs(1), one Sb(1), and one S(1) atom. In the fourth O site, O(4) is bonded in a single-bond geometry to two equivalent Cs(1) and one S(1) atom. There are two inequivalent F sites. In the first F site, F(2) is bonded in a distorted single-bond geometry to two equivalent Cs(1) and one Sb(1) atom. In the second F site, F(1) is bonded in a distorted single-bond geometry to three equivalent Cs(1) and one Sb(1) atom.