Structure 4519282

4519281 << 4519282 >> 4519320
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: Cd3 Ga5 K S11

Cell parameters:

  • a = 13.0701(3) Å
  • b = 11.6218(3) Å
  • c = 12.2714(3) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

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: Cd12 Ga20 S44 (Cd3 Ga5 S11)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 10, 25, 37, 66, 62, 118, 124, 201
  • 3, 9, 12, 26, 37, 71, 74, 131, 130, 213
  • 3, 9, 12, 27, 37, 71, 74, 128, 125, 211
  • 3, 9, 13, 27, 38, 75, 75, 124, 127, 223
  • 3, 9, 13, 28, 34, 66, 74, 133, 128, 207
  • 3, 9, 13, 29, 34, 65, 73, 133, 128, 203
  • 3, 9, 14, 29, 38, 75, 80, 135, 132, 219
  • 3, 9, 14, 29, 40, 77, 76, 132, 134, 225
  • 3, 9, 15, 31, 36, 71, 79, 137, 128, 211
  • 3, 9, 15, 31, 36, 72, 80, 134, 127, 218
  • 3, 9, 16, 32, 38, 77, 83, 137, 128, 217
  • 4, 7, 17, 26, 52, 54, 99, 106, 181, 164
  • 4, 7, 18, 26, 51, 57, 104, 103, 172, 172
  • 4, 8, 18, 24, 51, 56, 102, 109, 179, 155
  • 4, 8, 18, 24, 51, 58, 104, 108, 180, 163
  • 4, 8, 18, 24, 53, 62, 103, 99, 179, 175
  • 4, 8, 18, 25, 54, 64, 108, 101, 180, 175
  • 4, 8, 20, 23, 46, 57, 105, 100, 165, 168
  • 4, 8, 20, 24, 47, 56, 105, 108, 175, 160
span 1 {1 1 1}