CdC12H8S2(N5O)2 crystallizes in the orthorhombic P2_12_12_1 space group. Cd(1) is bonded in a distorted octahedral geometry to one N(1), one N(10), one N(5), one N(9), one O(1), and one O(2) atom. The Cd(1)-N(1) bond length is 2.22 Å. The Cd(1)-N(10) bond length is 2.22 Å. The Cd(1)-N(5) bond length is 2.31 Å. The Cd(1)-N(9) bond length is 2.31 Å. The Cd(1)-O(1) bond length is 2.47 Å. The Cd(1)-O(2) bond length is 2.65 Å. There are twelve inequivalent C sites. In the first C site, C(1) is bonded in a trigonal planar geometry to one N(1), one N(4), and one N(9) atom. The C(1)-N(1) bond length is 1.34 Å. The C(1)-N(4) bond length is 1.38 Å. The C(1)-N(9) bond length is 1.34 Å. In the second C site, C(2) is bonded in a distorted bent 120 degrees geometry to one C(3), one N(4), and one O(1) atom. The C(2)-C(3) bond length is 1.45 Å. The C(2)-N(4) bond length is 1.38 Å. The C(2)-O(1) bond length is 1.25 Å. In the third C site, C(3) is bonded in a trigonal planar geometry to one C(2), one C(4), and one S(1) atom. The C(3)-C(4) bond length is 1.39 Å. The C(3)-S(1) bond length is 1.73 Å. In the fourth C site, C(4) is bonded in a distorted single-bond geometry to one C(3), one C(5), and one H(1) atom. The C(4)-C(5) bond length is 1.41 Å. The C(4)-H(1) bond length is 1.09 Å. In the fifth C site, C(5) is bonded in a distorted single-bond geometry to one C(4), one C(6), and one H(2) atom. The C(5)-C(6) bond length is 1.38 Å. The C(5)-H(2) bond length is 1.09 Å. In the sixth C site, C(6) is bonded in a distorted single-bond geometry to one C(5), one H(3), and one S(1) atom. The C(6)-H(3) bond length is 1.09 Å. The C(6)-S(1) bond length is 1.70 Å. In the seventh C site, C(7) is bonded in a trigonal planar geometry to one N(10), one N(5), and one N(6) atom. The C(7)-N(10) bond length is 1.34 Å. The C(7)-N(5) bond length is 1.34 Å. The C(7)-N(6) bond length is 1.38 Å. In the eighth C site, C(8) is bonded in a distorted bent 120 degrees geometry to one C(9), one N(6), and one O(2) atom. The C(8)-C(9) bond length is 1.45 Å. The C(8)-N(6) bond length is 1.38 Å. The C(8)-O(2) bond length is 1.25 Å. In the ninth C site, C(9) is bonded in a trigonal planar geometry to one C(10), one C(8), and one S(2) atom. The C(9)-C(10) bond length is 1.39 Å. The C(9)-S(2) bond length is 1.73 Å. In the tenth C site, C(10) is bonded in a distorted single-bond geometry to one C(11), one C(9), and one H(4) atom. The C(10)-C(11) bond length is 1.41 Å. The C(10)-H(4) bond length is 1.09 Å. In the eleventh C site, C(11) is bonded in a distorted trigonal planar geometry to one C(10), one C(12), and one H(5) atom. The C(11)-C(12) bond length is 1.38 Å. The C(11)-H(5) bond length is 1.09 Å. In the twelfth C site, C(12) is bonded in a distorted single-bond geometry to one C(11), one H(6), and one S(2) atom. The C(12)-H(6) bond length is 1.08 Å. The C(12)-S(2) bond length is 1.70 Å. There are ten inequivalent N sites. In the first N site, N(10) is bonded in a distorted trigonal planar geometry to one Cd(1), one C(7), and one N(8) atom. The N(10)-N(8) bond length is 1.36 Å. In the second N site, N(1) is bonded in a distorted trigonal planar geometry to one Cd(1), one C(1), and one N(2) atom. The N(1)-N(2) bond length is 1.36 Å. In the third N site, N(2) is bonded in a water-like geometry to one N(1) and one N(3) atom. The N(2)-N(3) bond length is 1.30 Å. In the fourth N site, N(3) is bonded in a water-like geometry to one N(2) and one N(9) atom. The N(3)-N(9) bond length is 1.36 Å. In the fifth N site, N(4) is bonded in a trigonal planar geometry to one C(1), one C(2), and one H(7) atom. The N(4)-H(7) bond length is 1.02 Å. In the sixth N site, N(5) is bonded in a distorted trigonal planar geometry to one Cd(1), one C(7), and one N(7) atom. The N(5)-N(7) bond length is 1.36 Å. In the seventh N site, N(6) is bonded in a trigonal planar geometry to one C(7), one C(8), and one H(8) atom. The N(6)-H(8) bond length is 1.03 Å. In the eighth N site, N(7) is bonded in a water-like geometry to one N(5) and one N(8) atom. The N(7)-N(8) bond length is 1.30 Å. In the ninth N site, N(8) is bonded in a water-like geometry to one N(10) and one N(7) atom. In the tenth N site, N(9) is bonded in a 3-coordinate geometry to one Cd(1), one C(1), and one N(3) atom. There are eight inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(4) atom. In the second H site, H(2) is bonded in a single-bond geometry to one C(5) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(6) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one C(10) atom. In the fifth H site, H(5) is bonded in a single-bond geometry to one C(11) atom. In the sixth H site, H(6) is bonded in a single-bond geometry to one C(12) atom. In the seventh H site, H(7) is bonded in a single-bond geometry to one N(4) atom. In the eighth H site, H(8) is bonded in a single-bond geometry to one N(6) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in an L-shaped geometry to one C(3) and one C(6) atom. In the second S site, S(2) is bonded in an L-shaped geometry to one C(12) and one C(9) atom. There are two inequivalent O sites. In the first O site, O(1) is bonded in a distorted single-bond geometry to one Cd(1) and one C(2) atom. In the second O site, O(2) is bonded in a single-bond geometry to one Cd(1) and one C(8) atom. Linkers: 7 O=C(NC1=NN=N[N]1)c1cccs1. Metal clusters: 4 [Cd]. The MOF has largest included sphere 2.15 A, density 2.00 g/cm3, surface area 3749.88 m2/g, accessible volume 0.14 cm3/g