CuC16H14S2(N2Cl)2 is Protactinium structured and crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two CuC16H14S2(N2Cl)2 clusters. Cu(1) is bonded in a square co-planar geometry to two equivalent N(1) and two equivalent Cl(1) atoms. Both Cu(1)-N(1) bond lengths are 1.99 Å. Both Cu(1)-Cl(1) bond lengths are 2.26 Å. There are eight inequivalent C sites. In the first C site, C(1) is bonded in a distorted trigonal planar geometry to one C(2), one N(1), and one H(1) atom. The C(1)-C(2) bond length is 1.39 Å. The C(1)-N(1) bond length is 1.34 Å. The C(1)-H(1) bond length is 1.09 Å. In the second C site, C(2) is bonded in a distorted single-bond geometry to one C(1) and one H(2) atom. The C(2)-H(2) bond length is 1.08 Å. In the third C site, C(3) is bonded in a distorted trigonal planar geometry to one N(2) and one H(3) atom. The C(3)-N(2) bond length is 1.34 Å. The C(3)-H(3) bond length is 1.09 Å. In the fourth C site, C(4) is bonded in a distorted trigonal planar geometry to one N(1), one N(2), and one S(1) atom. The C(4)-N(1) bond length is 1.36 Å. The C(4)-N(2) bond length is 1.34 Å. The C(4)-S(1) bond length is 1.74 Å. In the fifth C site, C(5) is bonded in a distorted water-like geometry to one C(6), one H(4), one H(5), and one S(1) atom. The C(5)-C(6) bond length is 1.50 Å. The C(5)-H(4) bond length is 1.10 Å. The C(5)-H(5) bond length is 1.10 Å. The C(5)-S(1) bond length is 1.83 Å. In the sixth C site, C(6) is bonded in a trigonal planar geometry to one C(5), one C(7), and one C(8) atom. The C(6)-C(7) bond length is 1.40 Å. The C(6)-C(8) bond length is 1.40 Å. In the seventh C site, C(7) is bonded in a distorted single-bond geometry to one C(6) and one H(6) atom. The C(7)-H(6) bond length is 1.09 Å. In the eighth C site, C(8) is bonded in a distorted single-bond geometry to one C(6) and one H(7) atom. The C(8)-H(7) bond length is 1.09 Å. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one Cu(1), one C(1), and one C(4) atom. In the second N site, N(2) is bonded in a bent 120 degrees geometry to one C(3) and one C(4) atom. There are seven inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(1) atom. In the second H site, H(2) is bonded in a single-bond geometry to one C(2) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(3) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one C(5) atom. In the fifth H site, H(5) is bonded in a single-bond geometry to one C(5) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one C(7) atom. In the seventh H site, H(7) is bonded in a single-bond geometry to one C(8) atom. S(1) is bonded in a water-like geometry to one C(4) and one C(5) atom. Cl(1) is bonded in a single-bond geometry to one Cu(1) atom. Linkers: 1 c1cnc(SCc2ccc(CSc3ncccn3)cc2)nc1 ,2 [CH]=NC(=[N])SCc1ccc(CSc2ncccn2)cc1. Metal clusters: 2 Cl[Cu]Cl. The MOF has largest included sphere 1.83 A, density 1.74 g/cm3, surface area 4678.78 m2/g, accessible volume 0.12 cm3/g