Structure 1521138

1521137 << 1521138 >> 1521139
Original COD entry Download CIF Download DOT

Citation: Haznar, A.; Studenyak, I.P.; Pietraszko, A. (1999). X-ray study of the superionic phase transition in Cu6 P S5 Br. Solid State Ionics, 119, pp. 31-36.

Formula: Br0.98 Cu6 P S4.98

Chemical name: Cu6 P S4.98 Br0.98

Cell parameters:

  • a = 9.73 Å
  • b = 9.73 Å
  • c = 9.73 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: Br4 Cu72 P4 S20 (Br Cu18 P S5)

Multiplicity: 1

Coordination sequences:

  • 4, 36, 70, 192, 332, 562, 844, 1190, 1616, 2070
  • 10, 42, 117, 245, 433, 706, 1018, 1394, 1759, 2300
  • 12, 40, 90, 196, 368, 638, 852, 1298, 1576, 2182
  • 14, 56, 147, 298, 517, 772, 1128, 1459, 1941, 2369
  • 17, 65, 155, 311, 533, 829, 1122, 1534, 1935, 2509
  • 18, 64, 172, 340, 526, 800, 1172, 1560, 1982, 2476
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