Structure 1561119

1561118 << 1561119 >> 1561120
Original COD entry Download CIF Download DOT

Citation: Xie, Zhiqing; Su, Xin; Ding, Hanqin; Li, Hongyi (2018). Crystal structures and theoretical studies of polyphosphate LiZnP3O9 for nonlinear optical applications. Journal of Solid State Chemistry, 262, pp. 313-319.

Formula: Li O9 P3 Zn

Cell parameters:

  • a = 8.330(3) Å
  • b = 8.520(3) Å
  • c = 8.635(3) 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: O36 P12 Zn4 (O9 P3 Zn)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 5, 20, 20, 61, 42, 113, 72, 201
  • 2, 6, 6, 25, 23, 63, 43, 128, 80, 209
  • 2, 6, 6, 25, 23, 64, 43, 123, 78, 214
  • 2, 8, 7, 22, 21, 67, 45, 124, 78, 203
  • 2, 8, 7, 22, 22, 68, 45, 124, 78, 205
  • 2, 8, 8, 24, 20, 65, 46, 128, 80, 201
  • 2, 8, 8, 24, 21, 68, 48, 132, 78, 206
  • 2, 8, 8, 25, 21, 66, 45, 129, 84, 213
  • 2, 8, 8, 25, 23, 72, 46, 127, 82, 212
  • 4, 4, 15, 14, 45, 36, 98, 61, 174, 103
  • 4, 4, 15, 14, 46, 36, 98, 64, 178, 105
  • 4, 4, 16, 16, 49, 34, 97, 66, 180, 107
  • 6, 6, 17, 16, 54, 38, 110, 71, 178, 105
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