Structure 1569398

1569397 << 1569398 >> 1569399
Original COD entry Download CIF Download DOT

Citation: Thom, Alexander J. R.; Turner, Gemma F.; Davis, Zachary H.; Ward, Martin R.; Pakamorė , Ignas; Hobday, Claire L.; Allan, David R.; Warren, Mark R.; Leung, Wai L. W.; Oswald, Iain D. H.; Morris, Russell E.; Moggach, Stephen A.; Ashbrook, Sharon E.; Forgan, Ross S. (2023). Pressure-induced postsynthetic cluster anion substitution in a MIL-53 topology scandium metal-organic framework.. Chemical science, 14, pp. 7716-7724.

Formula: C37.5 H40.2 O15.5 Sc2

Cell parameters:

  • a = 7.0769(14) Å
  • b = 22.232(4) Å
  • c = 13.6130(15) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
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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: C68 H76 O20 Sc4 (C17 H19 O5 Sc)

Multiplicity: 2

span 1 {1 1 1}