Structure 7228408

7228407 << 7228408 >> 7228409
Original COD entry Download CIF Download DOT

Citation: Nian, Leyan; Huang, Junben; Wu, Kui; Su, Zhi; Yang, Zhihua; Pan, Shilie (2017). BaCu2MIVQ4 (MIV = Si, Ge, and Sn; Q = S, Se): synthesis, crystal structures, optical performances and theoretical calculations. RSC Adv., 7, pp. 29378-.

Formula: Ba Cu2 Se4 Sn

Cell parameters:

  • a = 11.101(10) Å
  • b = 11.189(10) Å
  • c = 6.728(6) 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: Cu8 Se16 Sn4 (Cu2 Se4 Sn)

Multiplicity: 1

Coordination sequences:

  • 3, 8, 12, 32, 38, 78, 83, 128, 149, 202
  • 3, 8, 14, 36, 40, 78, 95, 124, 153, 212
  • 3, 11, 14, 32, 48, 76, 88, 134, 151, 212
  • 4, 8, 20, 24, 58, 68, 98, 126, 168, 178
  • 5, 8, 20, 32, 54, 68, 104, 117, 177, 189
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