Structure 1569546

1569473 << 1569546 >> 1569591
Original COD entry Download CIF Download DOT

Citation: Nandi, Shyamapada; Mansouri, Asma; Dovgaliuk, Iurii; Boullay, Philippe; Patriarche, Gilles; Cornu, Ieuan; Florian, Pierre; Mouchaham, Georges; Serre, Christian (2023). A robust ultra-microporous cationic aluminum-based metal-organic framework with a flexible tetra-carboxylate linker. Communications Chemistry, 6, pp. 1-8.

Formula: C144 Al18 Cl6 O93

Chemical name: Aluminum cloride (5, 5'-Methylenediisophthalate)

Cell parameters:

  • a = 14.2995(3) Å
  • b = 14.2995(3) Å
  • c = 24.3801(10) Å
  • α = 90.0000°
  • β = 90.0000°
  • γ = 120.000°

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: C102 Al18 O84 (C17 Al3 O14)

Multiplicity: 1

Coordination sequences:

  • 1, 5, 5, 16, 13, 25, 26, 39, 35, 57
  • 2, 4, 4, 5, 13, 11, 30, 23, 58, 48
  • 2, 4, 4, 6, 8, 8, 36, 24, 66, 50
  • 2, 4, 5, 5, 19, 14, 35, 28, 48, 49
  • 2, 7, 6, 16, 14, 26, 27, 46, 37, 61
  • 2, 7, 7, 14, 13, 27, 24, 39, 34, 51
  • 2, 10, 7, 18, 16, 31, 30, 40, 39, 57
  • 2, 10, 7, 18, 17, 29, 30, 44, 37, 66
  • 3, 3, 5, 6, 7, 22, 16, 51, 37, 77
  • 3, 4, 5, 12, 10, 28, 22, 44, 40, 69
  • 3, 4, 11, 9, 20, 18, 39, 32, 47, 47
  • 6, 5, 16, 13, 25, 26, 39, 35, 57, 49
  • 6, 6, 14, 12, 26, 24, 36, 32, 44, 50
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