Structure 4124533

4124532 << 4124533 >> 4124534
Original COD entry Download CIF Download DOT

Citation: Hyett, G.; Clarke, S.J.; Rutt, O.J.; Gal, Z.A.; Denis, S.G.; Hayward, M.A. (2004). Electronically driven structural distortions in lithium intercalates of the n=2 Ruddlesden-Popper-type host Y2 Ti2 O5 S2: synthesis, structure and properties of Lix Y2 Ti2 O5 S2 (0 < x <2). Journal of the American Chemical Society, 126, pp. 1980-1991.

Formula: Li O5 S2 Ti2 Y2

Chemical name: Li1.00 Y2 Ti2 O5 S2

Cell parameters:

  • a = 3.83189 Å
  • b = 3.91881 Å
  • c = 22.3007 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: O10 S4 Ti4 Y4 (O5 S2 Ti2 Y2)

Multiplicity: 1

Coordination sequences:

  • 2, 18, 66, 128, 238, 292, 444, 574, 764, 886
  • 4, 26, 52, 126, 188, 292, 404, 545, 669, 878
  • 4, 28, 60, 124, 200, 278, 422, 523, 705, 838
  • 6, 47, 79, 139, 230, 339, 443, 613, 704, 950
  • 10, 34, 77, 155, 214, 343, 437, 606, 734, 948
  • 15, 37, 87, 144, 230, 330, 471, 561, 773, 902
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