TiMoCC is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. Ti(1) is bonded to six equivalent C(1) atoms to form TiC6 octahedra that share corners with six equivalent Mo(1)C6 octahedra, edges with six equivalent Ti(1)C6 octahedra, and edges with six equivalent Mo(1)C6 octahedra. The corner-sharing octahedral tilt angles are 1°. Mo(1) is bonded to six equivalent C(1) atoms to form MoC6 octahedra that share corners with six equivalent Ti(1)C6 octahedra, edges with six equivalent Ti(1)C6 octahedra, and edges with six equivalent Mo(1)C6 octahedra. The corner-sharing octahedral tilt angles are 1°. C(1) is bonded to three equivalent Ti(1) and three equivalent Mo(1) atoms to form a mixture of edge and corner-sharing CTi3Mo3 octahedra. The corner-sharing octahedra are not tilted.
TiMoCC is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. Ti(1) is bonded to six equivalent C(1) atoms to form TiC6 octahedra that share corners with six equivalent Mo(1)C6 octahedra, edges with six equivalent Ti(1)C6 octahedra, and edges with six equivalent Mo(1)C6 octahedra. The corner-sharing octahedral tilt angles are 1°. All Ti(1)-C(1) bond lengths are 2.16 Å. Mo(1) is bonded to six equivalent C(1) atoms to form MoC6 octahedra that share corners with six equivalent Ti(1)C6 octahedra, edges with six equivalent Ti(1)C6 octahedra, and edges with six equivalent Mo(1)C6 octahedra. The corner-sharing octahedral tilt angles are 1°. All Mo(1)-C(1) bond lengths are 2.19 Å. C(1) is bonded to three equivalent Ti(1) and three equivalent Mo(1) atoms to form a mixture of edge and corner-sharing CTi3Mo3 octahedra. The corner-sharing octahedra are not tilted.