KTiS2 is Caswellsilverite-like structured and crystallizes in the trigonal R3m space group. K(1) is bonded in a 6-coordinate geometry to three equivalent S(1) and three equivalent S(2) atoms. Ti(1) is bonded to three equivalent S(1) and three equivalent S(2) atoms to form edge-sharing TiS6 octahedra. There are two inequivalent S sites. In the first S site, S(1) is bonded to three equivalent K(1) and three equivalent Ti(1) atoms to form edge-sharing SK3Ti3 octahedra. In the second S site, S(2) is bonded in a 6-coordinate geometry to three equivalent K(1) and three equivalent Ti(1) atoms.
KTiS2 is Caswellsilverite-like structured and crystallizes in the trigonal R3m space group. K(1) is bonded in a 6-coordinate geometry to three equivalent S(1) and three equivalent S(2) atoms. All K(1)-S(1) bond lengths are 3.10 Å. All K(1)-S(2) bond lengths are 3.15 Å. Ti(1) is bonded to three equivalent S(1) and three equivalent S(2) atoms to form edge-sharing TiS6 octahedra. All Ti(1)-S(1) bond lengths are 2.51 Å. All Ti(1)-S(2) bond lengths are 2.52 Å. There are two inequivalent S sites. In the first S site, S(1) is bonded to three equivalent K(1) and three equivalent Ti(1) atoms to form edge-sharing SK3Ti3 octahedra. In the second S site, S(2) is bonded in a 6-coordinate geometry to three equivalent K(1) and three equivalent Ti(1) atoms.