CsCN5H2 crystallizes in the orthorhombic Pnma space group. Cs(1) is bonded in a 9-coordinate geometry to one N(1), four equivalent N(2), and four equivalent N(3) atoms. C(1) is bonded in a trigonal planar geometry to one N(1) and two equivalent N(3) atoms. There are three inequivalent N sites. In the first N site, N(1) is bonded in a distorted trigonal non-coplanar geometry to one Cs(1), one C(1), and two equivalent H(1) atoms. In the second N site, N(2) is bonded in a 2-coordinate geometry to two equivalent Cs(1), one N(2), and one N(3) atom. In the third N site, N(3) is bonded in a distorted single-bond geometry to two equivalent Cs(1), one C(1), and one N(2) atom. H(1) is bonded in a single-bond geometry to one N(1) atom.
CsCN5H2 crystallizes in the orthorhombic Pnma space group. Cs(1) is bonded in a 9-coordinate geometry to one N(1), four equivalent N(2), and four equivalent N(3) atoms. The Cs(1)-N(1) bond length is 3.52 Å. There are two shorter (3.29 Å) and two longer (3.54 Å) Cs(1)-N(2) bond lengths. There are two shorter (3.28 Å) and two longer (3.34 Å) Cs(1)-N(3) bond lengths. C(1) is bonded in a trigonal planar geometry to one N(1) and two equivalent N(3) atoms. The C(1)-N(1) bond length is 1.38 Å. Both C(1)-N(3) bond lengths are 1.35 Å. There are three inequivalent N sites. In the first N site, N(1) is bonded in a distorted trigonal non-coplanar geometry to one Cs(1), one C(1), and two equivalent H(1) atoms. Both N(1)-H(1) bond lengths are 1.02 Å. In the second N site, N(2) is bonded in a 2-coordinate geometry to two equivalent Cs(1), one N(2), and one N(3) atom. The N(2)-N(2) bond length is 1.31 Å. The N(2)-N(3) bond length is 1.36 Å. In the third N site, N(3) is bonded in a distorted single-bond geometry to two equivalent Cs(1), one C(1), and one N(2) atom. H(1) is bonded in a single-bond geometry to one N(1) atom.