Structure 4519280

4519279 << 4519280 >> 4519281
Original COD entry Download CIF Download DOT

Citation: Yang, Long-Qi; Jiang, Xiao-Ming; Pei, Shao-Min; Chen, Wen-Fa; Liu, Bin-Wen; Guo, Guo-Cong (2022). Optimizing the Nonlinear Optical Performance of an A-N-M-Q (A: Alkali Metal; N: d10 Metal; M: Main Group Metal; Q: Chalcogen) System.. ACS applied materials & interfaces, 14, pp. 4352-4359.

Formula: Cd2 Cs2 Ga8 S15

Cell parameters:

  • a = 11.8574(5) Å
  • b = 12.9781(6) Å
  • c = 17.5270(8) Å
  • α = 90°
  • β = 90°
  • γ = 90°

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: Cd8 Ga32 S60 (Cd2 Ga8 S15)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 10, 22, 22, 43, 43, 85, 85, 154
  • 2, 6, 10, 22, 23, 48, 48, 91, 92, 159
  • 2, 6, 10, 22, 26, 50, 43, 87, 97, 171
  • 3, 9, 11, 22, 24, 50, 53, 100, 91, 164
  • 3, 9, 11, 23, 25, 51, 56, 104, 90, 160
  • 3, 9, 12, 24, 22, 44, 50, 97, 89, 163
  • 3, 9, 13, 27, 25, 48, 48, 97, 101, 177
  • 4, 6, 14, 18, 38, 38, 76, 78, 136, 106
  • 4, 6, 16, 22, 40, 30, 64, 76, 142, 128
  • 4, 7, 15, 17, 37, 39, 74, 76, 142, 108
  • 4, 7, 16, 17, 35, 37, 74, 73, 132, 111
  • 4, 7, 16, 18, 35, 34, 70, 71, 135, 118
  • 4, 9, 20, 16, 33, 42, 82, 75, 138, 113
  • 4, 12, 10, 20, 24, 48, 58, 112, 82, 146
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