Structure 4124537

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Original COD entry Download CIF Download DOT

Citation: Hyett, G.; Rutt, O.J.; Gal, Z.A.; Denis, S.G.; Hayward, M.A.; Clarke, S.J. (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: Li1.04 O5 S2 Ti2 Y2

Chemical name: Li1.04 Y2 Ti2 O5 S2

Cell parameters:

  • a = 3.8189 Å
  • b = 3.8542 Å
  • c = 22.468 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, 74, 168, 284, 392, 550, 738, 950, 1170
  • 4, 28, 64, 144, 230, 348, 500, 655, 853, 1062
  • 6, 53, 105, 173, 290, 421, 581, 753, 938, 1182
  • 10, 38, 97, 185, 284, 421, 569, 754, 958, 1178
  • 17, 49, 105, 186, 286, 426, 581, 745, 957, 1182
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