Materials Data on P2IrClF6 by Materials Project
IrCl(PF3)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of sixteen phosphorus trifluoride molecules and four IrCl clusters. In each IrCl cluster, there are two inequivalent Ir5+ sites. In the first Ir5+ site, Ir5+ is bonded in an L-shaped geometry to two equivalent Cl1- atoms. Both Ir–Cl bond lengths are 2.43 Å. In the second Ir5+ site, Ir5+ is bonded in an L-shaped geometry to two equivalent Cl1- atoms. Both Ir–Cl bond lengths are 2.42 Å. Cl1- is bonded in a 2-coordinate geometry to two Ir5+ atoms.
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