Structure 4128586

4128585 << 4128586 >> 4128587
Original COD entry Download CIF Download DOT

Citation: Lorzing, Gregory R.; Gosselin, Eric J.; Trump, Benjamin A.; York, Arthur H. P.; Sturluson, Arni; Rowland, Casey A.; Yap, Glenn P. A.; Brown, Craig M.; Simon, Cory M.; Bloch, Eric D. (2019). Understanding Gas Storage in Cuboctahedral Porous Coordination Cages.. Journal of the American Chemical Society, 141, pp. 12128-12138.

Formula: C36.89 H22.5 D10.52 Fe2 N1.65 O11.61

Cell parameters:

  • a = 40.233(6) Å
  • b = 40.233(6) Å
  • c = 40.233(6) Å
  • α = 90°
  • β = 90°
  • γ = 90°

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: C3792 H3744 D1776 Fe96 N80 O1344 (C237 H234 D111 Fe6 N5 O84)

span 1 {1 1 1}