Structure 4127958

4127957 << 4127958 >> 4127988
Original COD entry Download CIF Download DOT

Citation: Wang, Ruiqi; Chen, Haijie; Xiao, Yi; Hadar, Ido; Bu, Kejun; Zhang, Xian; Pan, Jie; Gu, Yuhao; Guo, Zhongnan; Huang, Fuqiang; Kanatzidis, Mercouri G. (2019). K x [Bi4-xMn x S6], Design of a Highly Selective Ion Exchange Material and Direct Gap 2D Semiconductor.. Journal of the American Chemical Society, 141, pp. 16903-16914.

Formula: Bi2.72 Mn1.28 S6 Zn0.64

Cell parameters:

  • a = 3.94702(17) Å
  • b = 3.94702(17) Å
  • c = 23.4271(17) Å
  • α = 90°
  • β = 90°
  • γ = 120°

List type: interleaving

List: 2D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 4

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: Bi2 Mn2 S3 (Bi2 Mn2 S3)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: Bi2 Mn2 S3 (Bi2 Mn2 S3)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: Zn2 (Zn)

Multiplicity: 1

RCSR Symbol: hcb

Coordination sequences:

  • 3, 6, 9, 12, 15, 18, 21, 24, 27, 30
span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: Zn2 (Zn)

Multiplicity: 1

RCSR Symbol: hcb

Coordination sequences:

  • 3, 6, 9, 12, 15, 18, 21, 24, 27, 30
span 1 {1 1 1}