Structure 7208623

7208620 << 7208623 >> 7208629
Original COD entry Download CIF Download DOT

Citation: Saito, Gunzi; Hosoda, Hidemasa; Yoshida, Yukihiro; Hagiwara, Jun; Nishimura, Kazukuni; Yamochi, Hideki; Otsuka, Akihiro; Hiramatsu, Takaaki; Shimazaki, Yuichi; Kirakci, Kaplan; Cordier, St\'ephane; Perrin, Christiane (2012). Synthesis and properties of charge-transfer solids with cluster units [Mo6X14]2− (X = Br, I). Journal of Materials Chemistry, 22, pp. 19774-.

Formula: C52 H44 I14 Mo6 N4 S8

Chemical name: Molybdate(2-), dodeca-m-iododiiodohexa-, octahedro, salt with4H-Cyclopenta-1,3-dithiole, 2-(5,6-dihydro-4H-cyclopenta-1,3-dithiol-2-ylidene)-5,6-dihydro-, compd. with benzonitrile (1:2:4)

Cell parameters:

  • a = 11.130(3) Å
  • b = 14.652(8) Å
  • c = 14.653(3) Å
  • α = 116.91(3)°
  • β = 108.16(2)°
  • γ = 95.13(3)°

List type: noninterleaving

List: 1D

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: (0;1;1)

Dimensionality: 1

Formula: C16 H12 N4 (C4 H3 N)

Coordination sequences:

  • 1, 2, 4, 5, 3, 2, 2, 2, 6, 8
  • 1, 2, 5, 4, 3, 2, 2, 4, 5, 7
  • 1, 2, 6, 5, 3, 2, 2, 6, 8, 8
  • 1, 3, 5, 5, 3, 2, 4, 5, 7, 6
  • 2, 2, 4, 7, 8, 6, 3, 2, 2, 4
  • 2, 4, 5, 5, 5, 5, 5, 3, 4, 5
  • 3, 4, 5, 3, 2, 2, 2, 6, 8, 8
  • 3, 5, 4, 3, 2, 2, 4, 5, 7, 6
  • 3, 6, 5, 3, 2, 2, 6, 8, 8, 4
  • 4, 5, 5, 3, 2, 4, 5, 7, 6, 5
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