Structure 2104142

2104129 << 2104142 >> 2104144
Original COD entry Download CIF Download DOT

Citation: Yashima, Masatomo; Ogisu, Kiyonori; Domen, Kazunari (2008). Structure and electron density of oxysulfide Sm~2~Ti~2~S~2~O~4.9~, a visible-light-responsive photocatalyst. Acta Crystallographica Section B, 64, pp. 291-298.

Formula: O9.84 S4 Sm4 Ti4

Chemical name: samarium titanium oxysulfide

Cell parameters:

  • a = 3.82123(2) Å
  • b = 3.82123(2) Å
  • c = 22.96371(12) 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 Sm4 Ti4 (O5 S2 Sm2 Ti2)

Multiplicity: 1

Coordination sequences:

  • 2, 16, 74, 154, 292, 392, 508, 730, 934, 1096
  • 4, 28, 62, 142, 230, 324, 502, 650, 792, 1090
  • 5, 53, 105, 165, 281, 418, 537, 789, 917, 1089
  • 9, 38, 89, 189, 277, 404, 565, 725, 917, 1210
  • 17, 48, 105, 182, 278, 404, 590, 718, 941, 1160
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