Structure 7018571

7018570 << 7018571 >> 7018572
Original COD entry Download CIF Download DOT

Citation: Queen, Wendy L.; Bloch, Eric D.; Brown, Craig M.; Hudson, Matthew R.; Mason, Jarad A.; Murray, Leslie J.; Ramirez-Cuesta, Anibal Javier; Peterson, Vanessa K.; Long, Jeffrey R. (2012). Hydrogen adsorption in the metal-organic frameworks Fe(2)(dobdc) and Fe(2)(O(2))(dobdc).. Dalton transactions (Cambridge, England : 2003), 41, pp. 4180-4187.

Formula: C4 H D4.32 Fe O3

Chemical name: ?

Cell parameters:

  • a = 26.1021(28) Å
  • b = 26.1021 Å
  • c = 6.9107(12) Å
  • α = 90.0°
  • β = 90.0°
  • γ = 120.0°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

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: C72 H18 Fe18 O54 (C4 H Fe O3)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 4, 7, 15, 26, 34, 45, 57, 65
  • 2, 8, 13, 20, 25, 32, 42, 51, 71, 84
  • 3, 4, 7, 15, 26, 34, 45, 57, 65, 75
  • 3, 5, 14, 18, 23, 37, 47, 52, 64, 88
  • 3, 6, 7, 16, 27, 35, 46, 58, 65, 74
  • 3, 6, 13, 16, 21, 37, 48, 54, 66, 88
  • 3, 11, 14, 21, 27, 35, 46, 54, 76, 85
  • 3, 11, 17, 21, 27, 36, 48, 58, 76, 90
  • 7, 13, 18, 24, 32, 36, 45, 69, 79, 89
span 1 {1 1 1}