H2(Pb3OCl4F)2 crystallizes in the triclinic P-1 space group. The structure consists of two 1333-74-0 atoms inside a Pb3OCl4F framework. In the Pb3OCl4F framework, there are three inequivalent Pb sites. In the first Pb site, Pb(1) is bonded in a 8-coordinate geometry to one O(1), one Cl(2), one Cl(3), one Cl(4), two equivalent Cl(1), and two equivalent F(1) atoms. In the second Pb site, Pb(2) is bonded in a 7-coordinate geometry to one Cl(1), one Cl(3), two equivalent Cl(2), two equivalent Cl(4), and one F(1) atom. In the third Pb site, Pb(3) is bonded in a 3-coordinate geometry to two equivalent O(1), one Cl(2), one Cl(4), two equivalent Cl(3), and one F(1) atom. O(1) is bonded in a trigonal non-coplanar geometry to one Pb(1) and two equivalent Pb(3) atoms. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a 3-coordinate geometry to one Pb(2) and two equivalent Pb(1) atoms. In the second Cl site, Cl(2) is bonded in a distorted rectangular see-saw-like geometry to one Pb(1), one Pb(3), and two equivalent Pb(2) atoms. In the third Cl site, Cl(3) is bonded in a 4-coordinate geometry to one Pb(1), one Pb(2), and two equivalent Pb(3) atoms. In the fourth Cl site, Cl(4) is bonded in a distorted rectangular see-saw-like geometry to one Pb(1), one Pb(3), and two equivalent Pb(2) atoms. F(1) is bonded to one Pb(2), one Pb(3), and two equivalent Pb(1) atoms to form edge-sharing FPb4 tetrahedra.
H2(Pb3OCl4F)2 crystallizes in the triclinic P-1 space group. The structure consists of two 1333-74-0 atoms inside a Pb3OCl4F framework. In the Pb3OCl4F framework, there are three inequivalent Pb sites. In the first Pb site, Pb(1) is bonded in a 8-coordinate geometry to one O(1), one Cl(2), one Cl(3), one Cl(4), two equivalent Cl(1), and two equivalent F(1) atoms. The Pb(1)-O(1) bond length is 2.30 Å. The Pb(1)-Cl(2) bond length is 3.18 Å. The Pb(1)-Cl(3) bond length is 3.00 Å. The Pb(1)-Cl(4) bond length is 3.11 Å. There is one shorter (2.93 Å) and one longer (3.17 Å) Pb(1)-Cl(1) bond length. There is one shorter (2.55 Å) and one longer (2.64 Å) Pb(1)-F(1) bond length. In the second Pb site, Pb(2) is bonded in a 7-coordinate geometry to one Cl(1), one Cl(3), two equivalent Cl(2), two equivalent Cl(4), and one F(1) atom. The Pb(2)-Cl(1) bond length is 2.90 Å. The Pb(2)-Cl(3) bond length is 2.93 Å. There is one shorter (2.92 Å) and one longer (3.10 Å) Pb(2)-Cl(2) bond length. There is one shorter (3.00 Å) and one longer (3.06 Å) Pb(2)-Cl(4) bond length. The Pb(2)-F(1) bond length is 2.56 Å. In the third Pb site, Pb(3) is bonded in a 3-coordinate geometry to two equivalent O(1), one Cl(2), one Cl(4), two equivalent Cl(3), and one F(1) atom. Both Pb(3)-O(1) bond lengths are 2.27 Å. The Pb(3)-Cl(2) bond length is 3.18 Å. The Pb(3)-Cl(4) bond length is 3.04 Å. There is one shorter (3.12 Å) and one longer (3.24 Å) Pb(3)-Cl(3) bond length. The Pb(3)-F(1) bond length is 2.57 Å. O(1) is bonded in a trigonal non-coplanar geometry to one Pb(1) and two equivalent Pb(3) atoms. There are four inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a 3-coordinate geometry to one Pb(2) and two equivalent Pb(1) atoms. In the second Cl site, Cl(2) is bonded in a distorted rectangular see-saw-like geometry to one Pb(1), one Pb(3), and two equivalent Pb(2) atoms. In the third Cl site, Cl(3) is bonded in a 4-coordinate geometry to one Pb(1), one Pb(2), and two equivalent Pb(3) atoms. In the fourth Cl site, Cl(4) is bonded in a distorted rectangular see-saw-like geometry to one Pb(1), one Pb(3), and two equivalent Pb(2) atoms. F(1) is bonded to one Pb(2), one Pb(3), and two equivalent Pb(1) atoms to form edge-sharing FPb4 tetrahedra.