NaC7N3H12 is Tungsten structured and crystallizes in the orthorhombic Cmce space group. The structure is zero-dimensional and consists of four NaC7N3H12 clusters. Na(1) is bonded in a 3-coordinate geometry to one N(1) and two equivalent N(2) atoms. The Na(1)-N(1) bond length is 2.39 Å. Both Na(1)-N(2) bond lengths are 2.44 Å. There are four 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 1.37 Å. The C(1)-N(1) bond length is 1.38 Å. The C(1)-H(1) bond length is 1.10 Å. In the second C site, C(3) is bonded in a distorted trigonal planar geometry to one C(3) and two equivalent C(2) atoms. The C(3)-C(3) bond length is 1.39 Å. Both C(3)-C(2) bond lengths are 1.46 Å. In the third C site, C(2) is bonded in a distorted single-bond geometry to one C(1), one C(3), and one H(2) atom. The C(2)-H(2) bond length is 1.09 Å. In the fourth C site, C(4) is bonded in a distorted trigonal non-coplanar geometry to one N(2), one H(5), and one H(6) atom. The C(4)-N(2) bond length is 1.47 Å. The C(4)-H(5) bond length is 1.10 Å. The C(4)-H(6) bond length is 1.10 Å. There are two inequivalent N sites. In the first N site, N(1) is bonded in a trigonal planar geometry to one Na(1) and two equivalent C(1) atoms. In the second N site, N(2) is bonded in a 4-coordinate geometry to one Na(1), one C(4), one H(3), and one H(4) atom. The N(2)-H(3) bond length is 1.02 Å. The N(2)-H(4) bond length is 1.03 Å. There are six inequivalent H sites. In the first H site, H(4) is bonded in a single-bond geometry to one N(2) atom. In the second H site, H(1) is bonded in a single-bond geometry to one C(1) atom. In the third H site, H(5) is bonded in a single-bond geometry to one C(4) atom. In the fourth H site, H(2) is bonded in a single-bond geometry to one C(2) atom. In the fifth H site, H(6) is bonded in a single-bond geometry to one C(4) atom. In the sixth H site, H(3) is bonded in a single-bond geometry to one N(2) atom. Linkers: 2 c1cc(-c2ccncc2)ccn1 ,4 NCCN. Metal clusters: 4 [Na]. The MOF has largest included sphere 1.78 A, density 1.31 g/cm3, surface area 4996.13 m2/g, accessible volume 0.11 cm3/g