Structure 1551315

1551314 << 1551315 >> 1551360
Original COD entry Download CIF Download DOT

Citation: Sergey V. Ovsyannikov; Maxim Bykov; Elena Bykova; Denis P. Kozlenko; Alexander A. Tsirlin; Alexander E. Karkin; Vladimir V. Shchennikov; Sergey E. Kichanov; Huiyang Gou; Artem M. Abakumov; Ricardo Egoavil; Johan Verbeeck; Catherine McCammon; Vadim Dyadkin; Dmitry Chernyshov; Sander van Smaalen; Leonid S. Dubrovinsky (2016). Charge-ordering transition in iron oxide Fe4O5 involving competing dimer and trimer formation. Nature Chemistry, 8, pp. 501-508.

Formula: Fe4 O5

Cell parameters:

  • a = 8.5830(4) Å
  • b = 39.2492(5) Å
  • c = 12.5425(11) Å
  • α = 90°
  • β = 90°
  • γ = 90°

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: Fe192 O240 (Fe4 O5)

Multiplicity: 1

Coordination sequences:

  • 4, 31, 64, 113, 176, 250, 352, 475, 574, 759
  • 5, 29, 62, 111, 179, 262, 352, 471, 603, 734
  • 5, 30, 65, 121, 181, 273, 370, 478, 620, 757
  • 10, 29, 72, 117, 182, 274, 372, 475, 622, 781
  • 10, 30, 65, 116, 179, 264, 358, 468, 615, 742
  • 10, 32, 66, 120, 198, 266, 374, 504, 602, 754
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