Structure 1567090

1566994 << 1567090 >> 1567140
Original COD entry Download CIF Download DOT

Citation: Samperisi, Laura; Zou, Xiaodong; Huang, Zhehao (2022). How to get maximum structure information from anisotropic displacement parameters obtained by three-dimensional electron diffraction: an experimental study on metal--organic frameworks. IUCrJ, 9, pp. -.

Formula: C12 H6 Ga O5

Cell parameters:

  • a = 21.570(3) Å
  • b = 21.570(3) Å
  • c = 6.7000(13) 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: C96 H48 Ga8 O40 (C12 H6 Ga O5)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 4, 3, 3, 5, 5, 11, 16, 22
  • 1, 2, 4, 5, 6, 5, 11, 16, 22, 31
  • 1, 2, 4, 5, 7, 14, 17, 22, 31, 50
  • 2, 7, 7, 16, 17, 30, 32, 44, 52, 59
  • 2, 10, 8, 16, 18, 38, 44, 54, 52, 58
  • 3, 4, 3, 3, 5, 5, 11, 16, 22, 31
  • 3, 4, 5, 6, 5, 11, 16, 22, 31, 50
  • 3, 4, 5, 7, 14, 17, 22, 31, 50, 73
  • 3, 4, 13, 12, 19, 19, 36, 48, 57, 64
  • 3, 6, 7, 13, 10, 17, 25, 41, 54, 66
  • 3, 6, 8, 6, 11, 16, 22, 31, 50, 73
  • 6, 6, 14, 14, 30, 34, 46, 46, 54, 82
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