Structure 2108457

2108456 << 2108457 >> 2108458
Original COD entry Download CIF Download DOT

Citation: Lanza, Arianna E.; Gemmi, Mauro; Bindi, Luca; Mugnaioli, Enrico; Paar, Werner H. (2019). Daliranite, PbHgAs~2~S~5~: determination of the incommensurately modulated structure and revision of the chemical formula. Acta Crystallographica Section B, 75, pp. -.

Formula: As2 Hg Pb S5

Cell parameters:

  • a = 21.246(5) Å
  • b = 4.2897(9) Å
  • c = 9.5257(12) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

List: 2D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 4

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

Dimensionality: 2

Formula: As4 Hg S5 (As4 Hg S5)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 8, 13, 12, 17, 22, 26, 30, 31
  • 2, 4, 10, 12, 20, 22, 18, 22, 34, 32
  • 3, 6, 8, 16, 17, 18, 23, 26, 26, 38
  • 4, 6, 11, 12, 15, 19, 25, 27, 31, 30
  • 4, 10, 8, 10, 16, 20, 24, 30, 28, 34
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CIF datablock 1, entity 2 of 4

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

Dimensionality: 2

Formula: As4 Hg S5 (As4 Hg S5)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 8, 13, 12, 17, 22, 26, 30, 31
  • 2, 4, 10, 12, 20, 22, 18, 22, 34, 32
  • 3, 6, 8, 16, 17, 18, 23, 26, 26, 38
  • 4, 6, 11, 12, 15, 19, 25, 27, 31, 30
  • 4, 10, 8, 10, 16, 20, 24, 30, 28, 34
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CIF datablock 2, entity 3 of 4

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

Dimensionality: 2

Formula: As4 Hg S5 (As4 Hg S5)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 8, 13, 12, 17, 22, 26, 30, 31
  • 2, 4, 10, 12, 20, 22, 18, 22, 34, 32
  • 3, 6, 8, 16, 17, 18, 23, 26, 26, 38
  • 4, 6, 11, 12, 15, 19, 25, 27, 31, 30
  • 4, 10, 8, 10, 16, 20, 24, 30, 28, 34
span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

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

Dimensionality: 2

Formula: As4 Hg S5 (As4 Hg S5)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 8, 13, 12, 17, 22, 26, 30, 31
  • 2, 4, 10, 12, 20, 22, 18, 22, 34, 32
  • 3, 6, 8, 16, 17, 18, 23, 26, 26, 38
  • 4, 6, 11, 12, 15, 19, 25, 27, 31, 30
  • 4, 10, 8, 10, 16, 20, 24, 30, 28, 34
span 1 {1 1 1}