TlS is Caswellsilverite-derived structured and crystallizes in the trigonal R-3m space group. There are two inequivalent Tl sites. In the first Tl site, Tl(1) is bonded to six equivalent S(1) atoms to form a mixture of corner and edge-sharing TlS6 octahedra. The corner-sharing octahedral tilt angles are 10°. In the second Tl site, Tl(2) is bonded to six equivalent S(1) atoms to form a mixture of distorted corner and edge-sharing TlS6 octahedra. The corner-sharing octahedral tilt angles are 10°. S(1) is bonded to three equivalent Tl(1) and three equivalent Tl(2) atoms to form a mixture of distorted corner and edge-sharing STl6 octahedra. The corner-sharing octahedra are not tilted.
TlS is Caswellsilverite-derived structured and crystallizes in the trigonal R-3m space group. There are two inequivalent Tl sites. In the first Tl site, Tl(1) is bonded to six equivalent S(1) atoms to form a mixture of corner and edge-sharing TlS6 octahedra. The corner-sharing octahedral tilt angles are 10°. All Tl(1)-S(1) bond lengths are 2.75 Å. In the second Tl site, Tl(2) is bonded to six equivalent S(1) atoms to form a mixture of distorted corner and edge-sharing TlS6 octahedra. The corner-sharing octahedral tilt angles are 10°. All Tl(2)-S(1) bond lengths are 3.16 Å. S(1) is bonded to three equivalent Tl(1) and three equivalent Tl(2) atoms to form a mixture of distorted corner and edge-sharing STl6 octahedra. The corner-sharing octahedra are not tilted.