Materials Data on NiP2N2(O6F)2 by Materials Project

Ni(NO4)2(PO2F)2 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of four 14939-29-8 molecules and two Ni(NO4)2 clusters. In each Ni(NO4)2 cluster, Ni is bonded in a distorted octahedral geometry to six O atoms. There are a spread of Ni–O bond distances ranging from 1.85–2.59 Å. N is bonded in a bent 120 degrees geometry to two O atoms. Both N–O bond lengths are 1.22 Å. There are four inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one N atom. In the second O site, O is bonded in a 1-coordinate geometry to one Ni and one O atom. The O–O bond length is 1.33 Å. In the third O site, O is bonded in a 1-coordinate geometry to one Ni and one O atom. In the fourth O site, O is bonded in a distorted single-bond geometry to one Ni and one N atom.