Structure 4118946

4118945 << 4118946 >> 4118947
Original COD entry Download CIF Download DOT

Citation: Laura Ca\~nadillas-Delgado; Oscar Fabelo; J. Alberto Rodr\'iguez-Velamaz\'an; Marie-H\'el\`ene Lem\'ee-Cailleau; Sax A. Mason; Emilio Pardo; Francesc Lloret; Jiong-Peng Zhao; Xian-He Bu; Virginie Simonet; Claire V. Colin; Juan Rodr\'iguez-Carvajal (2012). The Role of Order-Disorder Transitions in the Quest for Molecular Multiferroics: Structural and Magnetic Neutron Studies of a Mixed Valence Iron(II)-Iron(III) Formate Framework. Journal of the American Chemical Society, 134, pp. 19772-19781.

Formula: C8 H14 Fe2 N O12

Cell parameters:

  • a = 8.2550(12) Å
  • b = 8.2550(12) Å
  • c = 13.891(3) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 120.00°

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: C12 H12 Fe4 O24 (C3 H3 Fe O6)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 10, 10, 20, 10, 50, 46, 88
  • 2, 7, 6, 15, 10, 35, 30, 71, 34, 99
  • 2, 7, 6, 15, 10, 35, 30, 71, 36, 111
  • 3, 2, 10, 10, 20, 10, 50, 46, 88, 28
  • 6, 6, 12, 6, 30, 30, 60, 18, 78, 78
  • 6, 6, 12, 6, 30, 30, 60, 20, 90, 90
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