Structure 4125022

4125021 << 4125022 >> 4125023
Original COD entry Download CIF Download DOT

Citation: Yu, Hongwei; Young, Joshua; Wu, Hongping; Zhang, Weiguo; Rondinelli, James M.; Halasyamani, P. Shiv (2016). Electronic, Crystal Chemistry, and Nonlinear Optical Property Relationships in the Dugganite A3B3CD2O14 Family.. Journal of the American Chemical Society, 138, pp. 4984-4989.

Formula: Ba3 O14 P2 Te Zn3

Chemical name: ?

Cell parameters:

  • a = 8.4744(3) Å
  • b = 8.4744(3) Å
  • c = 5.2818(4) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 120.00°

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: O14 P2 Te Zn3 (O14 P2 Te Zn3)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 9, 9, 39, 27, 72, 47, 140
  • 2, 6, 5, 19, 16, 51, 37, 102, 56, 151
  • 2, 8, 8, 24, 18, 52, 32, 98, 58, 156
  • 4, 3, 9, 9, 39, 27, 72, 47, 140, 69
  • 4, 4, 16, 12, 34, 26, 86, 46, 116, 70
  • 6, 6, 18, 14, 42, 24, 66, 44, 150, 72
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