Structure 1535994

1535993 << 1535994 >> 1535996
Original COD entry Download CIF Download DOT

Citation: Chang, J.S.; Wang, Y.; Hong, H.Y.-P.; Lee, G.H. (1990). Crystal structure and electric conductiviy of Ba Cu5.65 S4.5. Materials Research Bulletin, 25, pp. 863-869.

Formula: Ba Cu5.65 S4.5

Cell parameters:

  • a = 21.05 Å
  • b = 21.05 Å
  • c = 9.258 Å
  • α = 90°
  • β = 90°
  • γ = 120°

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: Cu126 S84 (Cu3 S2)

Multiplicity: 1

Coordination sequences:

  • 2, 7, 24, 49, 104, 158, 230, 343, 471, 613
  • 4, 23, 51, 98, 155, 245, 357, 475, 619, 783
  • 6, 27, 59, 102, 177, 265, 378, 512, 651, 833
  • 6, 27, 59, 104, 185, 275, 391, 521, 661, 851
  • 7, 19, 32, 85, 142, 209, 298, 433, 578, 769
  • 8, 27, 61, 106, 183, 266, 386, 522, 677, 842
  • 8, 28, 54, 103, 175, 268, 367, 503, 676, 822
  • 9, 21, 45, 89, 163, 243, 342, 470, 638, 799
  • 9, 30, 60, 115, 183, 276, 388, 536, 676, 855
  • 9, 33, 64, 129, 193, 300, 428, 539, 701, 885
  • 10, 20, 45, 89, 163, 243, 342, 470, 638, 799
  • 10, 30, 67, 121, 195, 291, 415, 532, 689, 879
  • 11, 29, 64, 121, 180, 289, 389, 533, 689, 853
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