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Cd2TlBi crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two Cd2TlBi ribbons oriented in the (1, 0, 0) direction. Cd is bonded in a linear geometry to one Tl and one Bi atom. The Cd–Tl bond length is 3.08 Å. The Cd–Bi bond length is 2.86 Å. Tl is bonded in a linear geometry to two equivalent Cd atoms. Bi is bonded in a linear geometry to two equivalent Cd atoms.
CdTl2Bi crystallizes in the orthorhombic Immm space group. The structure is one-dimensional and consists of two CdTl2Bi ribbons oriented in the (1, 0, 0) direction. Cd is bonded in a linear geometry to two equivalent Tl atoms. Both Cd–Tl bond lengths are 2.97 Å. Tl is bonded in a linear geometry to one Cd and one Bi atom. The Tl–Bi bond length is 2.81 Å. Bi is bonded in a linear geometry to two equivalent Tl atoms.