Structure 2005098

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Original COD entry Download CIF Download DOT

Citation: Boutfessi, A.; Boukhari, A.; Holt, E. M. (1996). Lead(II) Diiron(III) Pyrophosphate and Barium Diiron(III) Pyrophosphate. Acta Crystallographica Section C, 52, pp. 1594-1597.

Formula: Ba Fe2 O14 P4

Chemical name: Barium Iron^III^ Diphosphate

Cell parameters:

  • a = 10.586(2) Å
  • b = 10.463(2) Å
  • c = 9.685(2) Å
  • α = 90.0°
  • β = 103.16(3)°
  • γ = 90.0°

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: Fe8 O56 P16 (Fe O7 P2)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 5, 24, 21, 55, 36, 125, 78, 191
  • 2, 8, 7, 22, 18, 61, 45, 126, 75, 206
  • 2, 8, 7, 23, 18, 62, 45, 129, 72, 195
  • 2, 8, 8, 24, 18, 64, 46, 127, 74, 207
  • 2, 8, 8, 26, 22, 70, 45, 126, 72, 209
  • 2, 8, 8, 26, 22, 72, 45, 121, 70, 206
  • 2, 8, 8, 27, 23, 72, 45, 127, 72, 210
  • 4, 4, 17, 15, 44, 30, 101, 67, 175, 89
  • 4, 4, 17, 15, 44, 31, 103, 66, 166, 87
  • 6, 6, 16, 12, 50, 38, 102, 60, 176, 106
  • 6, 6, 18, 16, 58, 40, 104, 52, 168, 118
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