Structure 4004002

4004001 << 4004002 >> 4004010
Original COD entry Download CIF Download DOT

Citation: Laing, Craig C.; Shen, Jiahong; Chica, Daniel G.; Cuthriell, Shelby A.; Schaller, Richard D.; Wolverton, Chris; Kanatzidis, Mercouri G. (2021). Photoluminescent Re6Q8I2 (Q = S, Se) Semiconducting Cluster Compounds. Chemistry of Materials, , pp. -.

Formula: I2 Re6 S8

Cell parameters:

  • a = 6.3649(13) Å
  • b = 11.607(2) Å
  • c = 10.177(2) Å
  • α = 90°
  • β = 98.77(3)°
  • 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: I4 Re12 S16 (I Re3 S4)

Multiplicity: 1

Coordination sequences:

  • 2, 16, 20, 26, 72, 74, 120, 166, 172, 252
  • 3, 12, 10, 36, 51, 59, 116, 126, 164, 246
  • 3, 12, 10, 36, 51, 63, 116, 125, 167, 243
  • 4, 19, 15, 27, 84, 83, 91, 176, 192, 229
  • 9, 11, 21, 47, 51, 95, 122, 146, 208, 238
  • 9, 12, 17, 45, 68, 75, 127, 143, 201, 269
span 1 {1 1 1}