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Materials Data on CoAg(N3O4)2 by Materials Project

CoAg(NO2)4N2 crystallizes in the tetragonal P4/nnc space group. The structure is two-dimensional and consists of four ammonia molecules and two CoAg(NO2)4 sheets oriented in the (0, 0, 1) direction. In each CoAg(NO2)4 sheet, Co3+ is bonded in a 8-coordinate geometry to eight equivalent O2- atoms. All Co–O bond lengths are 2.30 Å. Ag1+ is bonded in a square co-planar geometry to four equivalent N2+ atoms. All Ag–N bond lengths are 2.30 Å. N2+ is bonded in a distorted bent 120 degrees geometry to one Ag1+ and two equivalent O2- atoms. Both N–O bond lengths are 1.25 Å. O2- is bonded in a distorted L-shaped geometry to one Co3+ and one N2+ atom.

36 MATERIALS SCIENCE↗

Materials Data on CoAg(N3O4)2 by Materials Project

CoAg(NO2)4N2 crystallizes in the tetragonal P4/nnc space group. The structure is zero-dimensional and consists of four ammonia molecules, two cobalt molecules, and two Ag(NO2)4 clusters. In each Ag(NO2)4 cluster, Ag1+ is bonded in a 8-coordinate geometry to eight equivalent O2- atoms. All Ag–O bond lengths are 2.54 Å. N2+ is bonded in a bent 120 degrees geometry to two equivalent O2- atoms. Both N–O bond lengths are 1.24 Å. O2- is bonded in a distorted single-bond geometry to one Ag1+ and one N2+ atom.

36 MATERIALS SCIENCE↗

Materials Data on CoAg(NO3)3 by Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

36 MATERIALS SCIENCE↗

Materials Data on CoAg(N3O4)2 by Materials Project

CoAgN2(NO2)4 crystallizes in the tetragonal P4/nnc space group. The structure is one-dimensional and consists of eight nitrous acid molecules and two CoAgN2 ribbons oriented in the (0, 0, 1) direction. In each CoAgN2 ribbon, Co3+ is bonded in a linear geometry to two equivalent N2+ atoms. Both Co–N bond lengths are 1.67 Å. Ag1+ is bonded in a linear geometry to two equivalent N2+ atoms. Both Ag–N bond lengths are 2.01 Å. N2+ is bonded in a linear geometry to one Co3+ and one Ag1+ atom.

36 MATERIALS SCIENCE↗