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Cuprite Cu₂O

A₂B · space group Pn-3m (No. 224) · Z = 2

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Unit cell

Lattice constants
a = 4.270 Å, b = 4.270 Å, c = 4.270 Å; α = 90°, β = 90°, γ = 90°
Cell volume
77.9 ų
Atoms in the cell
6 (O 2, Cu 4)
Formula units Z
2
Calculated density
6.10 g cm⁻³
Shortest contact
1.849 Å

Coordination

O
CN 4 at 1.85 Å (4 Cu)
Cu
CN 2 at 1.85 Å (2 O)

About the structure

  • bcc array of O²⁻; each O is tetrahedrally surrounded by Cu⁺ and each Cu⁺ is linear (O–Cu–O).
  • Coordination: Cu 2, O 4.
  • Two interpenetrating frameworks that do not bond to each other.
  • Ag₂O shares this structure.

Atom positions (fractional, one cell)

Atomxyz
O0.00000.00000.0000
O0.50000.50000.5000
Cu0.25000.25000.2500
Cu0.25000.75000.7500
Cu0.75000.25000.7500
Cu0.75000.75000.2500

Z, coordination numbers, distances, density and packing on this page are computed from these coordinates.

Other oxides & frameworks

Open Cuprite in the 3D viewer →  ·  All structures