Structure 1521842

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Original COD entry Download CIF Download DOT

Citation: Riou-Cavellec, M.; Serre, C.; Greneche, J.M.; Robino, J.; Nogues, M.; Ferey, G. (1999). Hydrothermal synthesis, powder structural determination, and magnetic study of the novel hydrated iron diphosphonate (Fe2 (H2 O)2 (O3 P - C H2 - P O3 H)2) (H2 O)2 or MIL-13. Journal of Solid State Chemistry, 147, pp. 122-131.

Formula: C2 H14 Fe2 O16 P4

Chemical name: (Fe2 (H2 O)2) ((O3 P) (C H2) (P O3 H))2 (H2 O)2

Cell parameters:

  • a = 9.849 Å
  • b = 8.031 Å
  • c = 9.915 Å
  • α = 99.089°
  • β = 97.91°
  • γ = 89.381°

List type: noninterleaving

List: 2D

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Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

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

Dimensionality: 2

Formula: C4 Fe4 O28 P8 (C Fe O7 P2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 11, 7, 20, 10, 34, 17, 44
  • 1, 5, 5, 13, 6, 23, 14, 35, 13, 47
  • 2, 6, 3, 13, 9, 22, 9, 36, 20, 46
  • 2, 8, 5, 14, 8, 26, 14, 39, 17, 53
  • 2, 8, 5, 14, 8, 27, 15, 39, 15, 49
  • 2, 8, 6, 18, 9, 28, 15, 43, 18, 49
  • 2, 8, 6, 19, 10, 28, 13, 40, 19, 54
  • 2, 8, 7, 20, 8, 26, 15, 44, 18, 48
  • 4, 3, 11, 7, 20, 10, 34, 17, 44, 18
  • 4, 4, 16, 9, 22, 9, 36, 20, 46, 15
  • 6, 5, 13, 6, 23, 14, 35, 13, 47, 24
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