Structure 4117367

4117366 << 4117367 >> 4117368
Original COD entry Download CIF Download DOT

Citation: Peng Yu; Liu-Jiang Zhou; Ling Chen (2012). Noncentrosymmetric Inorganic Open-Framework Chalcohalides with Strong Middle IR SHG and Red Emission: Ba3AGa5Se10Cl2 (A = Cs, Rb, K). Journal of the American Chemical Society, 134, pp. 2227-2235.

Formula: Ba3 Cl2 Ga5 K Se10

Chemical name: ?

Cell parameters:

  • a = 8.6341(7) Å
  • b = 8.6341(7) Å
  • c = 15.644(2) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

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

Dimensionality: 3

Formula: Ga10 Se20 (Ga Se2)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 4, 9, 8, 24, 24, 54, 34, 74
  • 2, 6, 6, 15, 12, 27, 18, 54, 48, 105
  • 4, 4, 9, 6, 18, 18, 45, 36, 75, 36
  • 4, 4, 12, 12, 24, 12, 36, 36, 96, 60
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