CuH8(C2N)4CuH48(C4N)12 is Indium-like structured and crystallizes in the tetragonal P-4b2 space group. The structure is zero-dimensional and consists of two CuH48(C4N)12 clusters and two CuH8(C2N)4 clusters. In each CuH48(C4N)12 cluster, Cu(2) is bonded in a tetrahedral geometry to four equivalent N(1) atoms. All Cu(2)-N(1) bond lengths are 2.04 Å. There are twelve inequivalent C sites. In the first C site, C(14) is bonded in a distorted single-bond geometry to one C(1) and one H(14) atom. The C(14)-C(1) bond length is 1.40 Å. The C(14)-H(14) bond length is 0.93 Å. In the second C site, C(1) is bonded in a trigonal planar geometry to one C(14), one C(2), and one C(5) atom. The C(1)-C(2) bond length is 1.36 Å. The C(1)-C(5) bond length is 1.49 Å. In the third C site, C(2) is bonded in a single-bond geometry to one C(1), one C(3), and one H(1) atom. The C(2)-C(3) bond length is 1.34 Å. The C(2)-H(1) bond length is 0.93 Å. In the fourth C site, C(3) is bonded in a 3-coordinate geometry to one C(2), one N(1), and one H(2) atom. The C(3)-N(1) bond length is 1.31 Å. The C(3)-H(2) bond length is 0.93 Å. In the fifth C site, C(4) is bonded in a distorted bent 120 degrees geometry to one N(1) and one H(3) atom. The C(4)-N(1) bond length is 1.31 Å. The C(4)-H(3) bond length is 0.93 Å. In the sixth C site, C(5) is bonded in a distorted single-bond geometry to one C(1), one C(11), and one N(2) atom. The C(5)-C(11) bond length is 1.45 Å. The C(5)-N(2) bond length is 1.21 Å. In the seventh C site, C(6) is bonded in a trigonal planar geometry to one C(10), one C(7), and one C(9) atom. The C(6)-C(10) bond length is 1.46 Å. The C(6)-C(7) bond length is 1.36 Å. The C(6)-C(9) bond length is 1.36 Å. In the eighth C site, C(7) is bonded in a distorted single-bond geometry to one C(6) and one H(4) atom. The C(7)-H(4) bond length is 0.93 Å. In the ninth C site, C(9) is bonded in a distorted single-bond geometry to one C(6) and one H(6) atom. The C(9)-H(6) bond length is 0.93 Å. In the tenth C site, C(10) is bonded in a distorted trigonal planar geometry to one C(12), one C(6), and one N(4) atom. The C(10)-C(12) bond length is 1.44 Å. The C(10)-N(4) bond length is 1.22 Å. In the eleventh C site, C(11) is bonded in a trigonal non-coplanar geometry to one C(5); one H(7); and two equivalent H(8,9) atoms. The C(11)-H(7) bond length is 0.96 Å. Both C(11)-H(8,9) bond lengths are 0.96 Å. In the twelfth C site, C(12) is bonded in a trigonal non-coplanar geometry to one C(10), one H(10), one H(11), and one H(12) atom. The C(12)-H(10) bond length is 0.96 Å. The C(12)-H(11) bond length is 0.96 Å. The C(12)-H(12) bond length is 0.96 Å. There are three inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one Cu(2), one C(3), and one C(4) atom. In the second N site, N(2) is bonded in a distorted single-bond geometry to one C(5) and one N(4) atom. The N(2)-N(4) bond length is 1.42 Å. In the third N site, N(4) is bonded in a distorted bent 120 degrees geometry to one C(10) and one N(2) atom. There are eleven inequivalent H sites. In the first H site, H(1) is bonded in a single-bond geometry to one C(2) atom. In the second H site, H(2) is bonded in a single-bond geometry to one C(3) atom. In the third H site, H(3) is bonded in a single-bond geometry to one C(4) atom. In the fourth H site, H(4) is bonded in a single-bond geometry to one C(7) atom. In the fifth H site, H(6) is bonded in a single-bond geometry to one C(9) atom. In the sixth H site, H(7) is bonded in a single-bond geometry to one C(11) atom. In the seventh H site, H(8,9) is bonded in a single-bond geometry to one C(11) atom. In the eighth H site, H(10) is bonded in a single-bond geometry to one C(12) atom. In the ninth H site, H(11) is bonded in a single-bond geometry to one C(12) atom. In the tenth H site, H(12) is bonded in a single-bond geometry to one C(12) atom. In the eleventh H site, H(14) is bonded in a single-bond geometry to one C(14) atom. In each CuH8(C2N)4 cluster, Cu(1) is bonded in a tetrahedral geometry to four equivalent N(3) atoms. All Cu(1)-N(3) bond lengths are 2.03 Å. There are two inequivalent C sites. In the first C site, C(13) is bonded in a distorted bent 120 degrees geometry to one N(3) and one H(13) atom. The C(13)-N(3) bond length is 1.29 Å. The C(13)-H(13) bond length is 0.93 Å. In the second C site, C(8) is bonded in a distorted bent 120 degrees geometry to one N(3) and one H(5) atom. The C(8)-N(3) bond length is 1.35 Å. The C(8)-H(5) bond length is 0.93 Å. N(3) is bonded in a trigonal planar geometry to one Cu(1), one C(13), and one C(8) atom. There are two inequivalent H sites. In the first H site, H(5) is bonded in a single-bond geometry to one C(8) atom. In the second H site, H(13) is bonded in a single-bond geometry to one C(13) atom. Linkers: 8 C[C]([N]/N=C(\C)c1ccncc1)c1ccncc1. Metal clusters: 4 [Cu]. The MOF has largest included sphere 4.76 A, density 1.13 g/cm3, surface area 5366.35 m2/g, accessible volume 0.37 cm3/g