Structure 4339693

4339683 << 4339693 >> 4339694
Original COD entry Download CIF Download DOT

Citation: Assoud, Abdeljalil; Xu, Jianxiao; Kleinke, Holger (2007). Structures and physical properties of new semiconducting polyselenides Ba2CudeltaAg4-deltaSe5 with unprecedented linear Se(3)4- units.. Inorganic chemistry, 46, pp. 9906-9911.

Formula: Ag3.12 Ba2 Cu0.88 Se5

Chemical name: ?

Cell parameters:

  • a = 16.1007(17) Å
  • b = 4.4842(5) Å
  • c = 9.2081(10) Å
  • α = 90.00°
  • β = 124.101(2)°
  • γ = 90.00°

List type: interleaving

List: 2D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 2

Basis: (0;1;0 0;0;1)

Dimensionality: 2

Formula: Ag4 Cu4 Se5 (Ag4 Cu4 Se5)

Multiplicity: 1

Coordination sequences:

  • 4, 18, 38, 32, 36, 68, 82, 64, 68, 116
  • 7, 19, 32, 37, 50, 59, 66, 75, 90, 97
  • 8, 16, 25, 31, 58, 60, 53, 69, 106, 96
  • 8, 19, 22, 34, 54, 60, 52, 76, 98, 100
  • 11, 16, 22, 34, 54, 60, 52, 76, 98, 100
  • 11, 21, 26, 37, 50, 59, 66, 75, 90, 97
  • 13, 20, 20, 44, 60, 48, 52, 92, 104, 80
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (0;1;0 0;0;1)

Dimensionality: 2

Formula: Ag4 Cu4 Se5 (Ag4 Cu4 Se5)

Multiplicity: 1

Coordination sequences:

  • 4, 18, 38, 32, 36, 68, 82, 64, 68, 116
  • 7, 19, 32, 37, 50, 59, 66, 75, 90, 97
  • 8, 16, 25, 31, 58, 60, 53, 69, 106, 96
  • 8, 19, 22, 34, 54, 60, 52, 76, 98, 100
  • 11, 16, 22, 34, 54, 60, 52, 76, 98, 100
  • 11, 21, 26, 37, 50, 59, 66, 75, 90, 97
  • 13, 20, 20, 44, 60, 48, 52, 92, 104, 80
span 1 {1 1 1}