NbNSCl6 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four NbNSCl6 clusters. In two of the NbNSCl6 clusters, Nb(1) is bonded in an octahedral geometry to one N(2), one Cl(10), one Cl(11), one Cl(12), one Cl(2), and one Cl(8) atom. N(2) is bonded in a bent 150 degrees geometry to one Nb(1) and one S(2) atom. S(2) is bonded in a bent 120 degrees geometry to one N(2) and one Cl(5) atom. There are six inequivalent Cl sites. In the first Cl site, Cl(2) is bonded in a single-bond geometry to one Nb(1) atom. In the second Cl site, Cl(5) is bonded in a single-bond geometry to one S(2) atom. In the third Cl site, Cl(8) is bonded in a single-bond geometry to one Nb(1) atom. In the fourth Cl site, Cl(10) is bonded in a single-bond geometry to one Nb(1) atom. In the fifth Cl site, Cl(11) is bonded in a single-bond geometry to one Nb(1) atom. In the sixth Cl site, Cl(12) is bonded in a single-bond geometry to one Nb(1) atom. In two of the NbNSCl6 clusters, Nb(2) is bonded in an octahedral geometry to one N(1), one Cl(3), one Cl(4), one Cl(6), one Cl(7), and one Cl(9) atom. N(1) is bonded in a linear geometry to one Nb(2) and one S(1) atom. S(1) is bonded in a bent 120 degrees geometry to one N(1) and one Cl(1) atom. There are six inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one S(1) atom. In the second Cl site, Cl(3) is bonded in a single-bond geometry to one Nb(2) atom. In the third Cl site, Cl(4) is bonded in a single-bond geometry to one Nb(2) atom. In the fourth Cl site, Cl(6) is bonded in a single-bond geometry to one Nb(2) atom. In the fifth Cl site, Cl(7) is bonded in a single-bond geometry to one Nb(2) atom. In the sixth Cl site, Cl(9) is bonded in a single-bond geometry to one Nb(2) atom.
NbNSCl6 is Indium-like structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of four NbNSCl6 clusters. In two of the NbNSCl6 clusters, Nb(1) is bonded in an octahedral geometry to one N(2), one Cl(10), one Cl(11), one Cl(12), one Cl(2), and one Cl(8) atom. The Nb(1)-N(2) bond length is 2.28 Å. The Nb(1)-Cl(10) bond length is 2.38 Å. The Nb(1)-Cl(11) bond length is 2.37 Å. The Nb(1)-Cl(12) bond length is 2.38 Å. The Nb(1)-Cl(2) bond length is 2.31 Å. The Nb(1)-Cl(8) bond length is 2.34 Å. N(2) is bonded in a bent 150 degrees geometry to one Nb(1) and one S(2) atom. The N(2)-S(2) bond length is 1.46 Å. S(2) is bonded in a bent 120 degrees geometry to one N(2) and one Cl(5) atom. The S(2)-Cl(5) bond length is 2.13 Å. There are six inequivalent Cl sites. In the first Cl site, Cl(2) is bonded in a single-bond geometry to one Nb(1) atom. In the second Cl site, Cl(5) is bonded in a single-bond geometry to one S(2) atom. In the third Cl site, Cl(8) is bonded in a single-bond geometry to one Nb(1) atom. In the fourth Cl site, Cl(10) is bonded in a single-bond geometry to one Nb(1) atom. In the fifth Cl site, Cl(11) is bonded in a single-bond geometry to one Nb(1) atom. In the sixth Cl site, Cl(12) is bonded in a single-bond geometry to one Nb(1) atom. In two of the NbNSCl6 clusters, Nb(2) is bonded in an octahedral geometry to one N(1), one Cl(3), one Cl(4), one Cl(6), one Cl(7), and one Cl(9) atom. The Nb(2)-N(1) bond length is 2.28 Å. The Nb(2)-Cl(3) bond length is 2.31 Å. The Nb(2)-Cl(4) bond length is 2.35 Å. The Nb(2)-Cl(6) bond length is 2.35 Å. The Nb(2)-Cl(7) bond length is 2.43 Å. The Nb(2)-Cl(9) bond length is 2.34 Å. N(1) is bonded in a linear geometry to one Nb(2) and one S(1) atom. The N(1)-S(1) bond length is 1.46 Å. S(1) is bonded in a bent 120 degrees geometry to one N(1) and one Cl(1) atom. The S(1)-Cl(1) bond length is 2.14 Å. There are six inequivalent Cl sites. In the first Cl site, Cl(1) is bonded in a single-bond geometry to one S(1) atom. In the second Cl site, Cl(3) is bonded in a single-bond geometry to one Nb(2) atom. In the third Cl site, Cl(4) is bonded in a single-bond geometry to one Nb(2) atom. In the fourth Cl site, Cl(6) is bonded in a single-bond geometry to one Nb(2) atom. In the fifth Cl site, Cl(7) is bonded in a single-bond geometry to one Nb(2) atom. In the sixth Cl site, Cl(9) is bonded in a single-bond geometry to one Nb(2) atom.