CdC6H6(N5O)2(CH3)2 crystallizes in the monoclinic Cc space group. The structure consists of eight 02329_fluka molecules inside a CdC6H6(N5O)2 framework. In the CdC6H6(N5O)2 framework, Cd(1) is bonded in an octahedral geometry to one N(2), one N(4), one N(6), one N(9), one O(1), and one O(2) atom. The Cd(1)-N(2) bond length is 2.25 Å. The Cd(1)-N(4) bond length is 2.37 Å. The Cd(1)-N(6) bond length is 2.25 Å. The Cd(1)-N(9) bond length is 2.33 Å. The Cd(1)-O(1) bond length is 2.47 Å. The Cd(1)-O(2) bond length is 2.44 Å. There are six inequivalent C sites. In the first C site, C(2) is bonded in a distorted water-like geometry to one C(3), one H(6), and one H(7) atom. The C(2)-C(3) bond length is 1.51 Å. The C(2)-H(6) bond length is 1.10 Å. The C(2)-H(7) bond length is 1.10 Å. In the second C site, C(3) is bonded in a distorted trigonal planar geometry to one C(2), one N(8), and one O(2) atom. The C(3)-N(8) bond length is 1.37 Å. The C(3)-O(2) bond length is 1.25 Å. In the third C site, C(4) is bonded in a trigonal planar geometry to one N(6), one N(8), and one N(9) atom. The C(4)-N(6) bond length is 1.34 Å. The C(4)-N(8) bond length is 1.38 Å. The C(4)-N(9) bond length is 1.35 Å. In the fourth C site, C(6) is bonded in a distorted water-like geometry to one C(7), one H(11), and one H(12) atom. The C(6)-C(7) bond length is 1.51 Å. The C(6)-H(11) bond length is 1.10 Å. The C(6)-H(12) bond length is 1.10 Å. In the fifth C site, C(7) is bonded in a distorted trigonal planar geometry to one C(6), one N(5), and one O(1) atom. The C(7)-N(5) bond length is 1.37 Å. The C(7)-O(1) bond length is 1.25 Å. In the sixth C site, C(8) is bonded in a trigonal planar geometry to one N(2), one N(4), and one N(5) atom. The C(8)-N(2) bond length is 1.34 Å. The C(8)-N(4) bond length is 1.35 Å. The C(8)-N(5) bond length is 1.38 Å. There are ten inequivalent N sites. In the first N site, N(1) is bonded in a 3-coordinate geometry to one N(2), one N(3), and one H(2) atom. The N(1)-N(2) bond length is 1.35 Å. The N(1)-N(3) bond length is 1.30 Å. The N(1)-H(2) bond length is 1.79 Å. In the second N site, N(2) is bonded in a distorted trigonal planar geometry to one Cd(1), one C(8), and one N(1) atom. In the third N site, N(3) is bonded in a water-like geometry to one N(1) and one N(4) atom. The N(3)-N(4) bond length is 1.36 Å. In the fourth N site, N(4) is bonded in a 3-coordinate geometry to one Cd(1), one C(8), and one N(3) atom. In the fifth N site, N(5) is bonded in a trigonal planar geometry to one C(7), one C(8), and one H(1) atom. The N(5)-H(1) bond length is 1.05 Å. In the sixth N site, N(6) is bonded in a distorted trigonal planar geometry to one Cd(1), one C(4), and one N(7) atom. The N(6)-N(7) bond length is 1.35 Å. In the seventh N site, N(7) is bonded in a 3-coordinate geometry to one N(10), one N(6), and one H(1) atom. The N(7)-N(10) bond length is 1.30 Å. The N(7)-H(1) bond length is 1.80 Å. In the eighth N site, N(8) is bonded in a trigonal planar geometry to one C(3), one C(4), and one H(2) atom. The N(8)-H(2) bond length is 1.05 Å. In the ninth N site, N(9) is bonded in a 3-coordinate geometry to one Cd(1), one C(4), and one N(10) atom. The N(9)-N(10) bond length is 1.35 Å. In the tenth N site, N(10) is bonded in a water-like geometry to one N(7) and one N(9) atom. There are six inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one N(5) and one N(7) atom. In the second H site, H(2) is bonded in a single-bond geometry to one N(1) and one N(8) atom. In the third H site, H(6) is bonded in a single-bond geometry to one C(2) atom. In the fourth H site, H(7) is bonded in a single-bond geometry to one C(2) atom. In the fifth H site, H(11) is bonded in a single-bond geometry to one C(6) atom. In the sixth H site, H(12) is bonded in a single-bond geometry to one C(6) 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(7) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Cd(1) and one C(3) atom. Linkers: 4 CCC(=O)NC1=NN=N[N]1. Metal clusters: 2 [Cd]. The MOF has largest included sphere 2.25 A, density 1.88 g/cm3, surface area 4074.24 m2/g, accessible volume 0.14 cm3/g