Structure 1511367

1511366 << 1511367 >> 1511368
Original COD entry Download CIF Download DOT

Citation: Pruss, T.; Kuchinke, J.; Doech, M.; Krebs, B.; Lindemann, A.; Koester, C. (2001). Li6-x Csx B10 Q18 (Q= S, Se; X<>1): New chalcogenoborates with polymeric layered anion networks. Phosphorus, Sulfur, Silicon and Related Elements, 169, pp. 281-284.

Formula: B10 Cs0.96 Li5.16 Se18

Chemical name: Li5.16 Cs0.96 (B10 Se18)

Cell parameters:

  • a = 10.0285 Å
  • b = 10.0285 Å
  • c = 27.743 Å
  • α = 90°
  • β = 90°
  • γ = 90°

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: B10 Se18 (B5 Se9)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 6, 12, 7, 13, 11, 22, 15, 31
  • 2, 6, 6, 12, 12, 20, 6, 18, 18, 36
  • 3, 9, 6, 9, 4, 10, 10, 21, 21, 36
  • 4, 4, 9, 9, 16, 9, 19, 12, 27, 27
  • 4, 6, 12, 5, 10, 8, 18, 18, 32, 18
span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

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

Dimensionality: 2

Formula: B10 Se18 (B5 Se9)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 6, 12, 7, 13, 11, 22, 15, 31
  • 2, 6, 6, 12, 12, 20, 6, 18, 18, 36
  • 3, 9, 6, 9, 4, 10, 10, 21, 21, 36
  • 4, 4, 9, 9, 16, 9, 19, 12, 27, 27
  • 4, 6, 12, 5, 10, 8, 18, 18, 32, 18
span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

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

Dimensionality: 2

Formula: B10 Se18 (B5 Se9)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 6, 12, 7, 13, 11, 22, 15, 31
  • 2, 6, 6, 12, 12, 20, 6, 18, 18, 36
  • 3, 9, 6, 9, 4, 10, 10, 21, 21, 36
  • 4, 4, 9, 9, 16, 9, 19, 12, 27, 27
  • 4, 6, 12, 5, 10, 8, 18, 18, 32, 18
span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

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

Dimensionality: 2

Formula: B10 Se18 (B5 Se9)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 6, 12, 7, 13, 11, 22, 15, 31
  • 2, 6, 6, 12, 12, 20, 6, 18, 18, 36
  • 3, 9, 6, 9, 4, 10, 10, 21, 21, 36
  • 4, 4, 9, 9, 16, 9, 19, 12, 27, 27
  • 4, 6, 12, 5, 10, 8, 18, 18, 32, 18
span 1 {1 1 1}