Structure 7122359

7122358 << 7122359 >> 7122360
Original COD entry Download CIF Download DOT

Citation: Yang, Huajun; Luo, Min; Wu, Zhou; Wang, Wei; Xue, Chaozhuang; Wu, Tao (2018). A semiconducting metal-chalcogenide-organic framework with square-planar tetra-coordinated sulfur.. Chemical communications (Cambridge, England), 54, pp. 11272-11275.

Formula: C72 Mn12 O48 S3

Cell parameters:

  • a = 15.8573(6) Å
  • b = 15.8573(6) Å
  • c = 15.8573(6) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: noninterleaving

List: 3D

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 1

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

Dimensionality: 3

Formula: C72 Mn12 O48 S3 (C24 Mn4 O16 S)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 5, 5, 16, 16, 33, 30, 32, 39
  • 2, 6, 8, 16, 13, 14, 21, 33, 33, 64
  • 3, 4, 5, 11, 11, 27, 26, 36, 36, 37
  • 3, 4, 9, 10, 17, 16, 26, 31, 44, 39
  • 4, 16, 8, 8, 16, 16, 24, 32, 24, 72
  • 5, 7, 16, 12, 12, 20, 24, 26, 58, 44
span 1 {1 1 1}