Structure 1548465

1548453 << 1548465 >> 1548466
Original COD entry Download CIF Download DOT

Citation: Gallagher, Audrey T.; Lee, Jung Yoon; Kathiresan, Venkatesan; Anderson, John S.; Hoffman, Brian M.; Harris, T. David (2018). A structurally-characterized peroxomanganese(iv) porphyrin from reversible O2 binding within a metal-organic framework.. Chemical science, 9, pp. 1596-1603.

Formula: C144 H72 Mn3 N12 O70 Zr12

Cell parameters:

  • a = 38.4015(12) Å
  • b = 38.4015(12) Å
  • c = 38.4015(12) 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: C576 H288 Mn24 N48 O352 Zr96 (C72 H36 Mn3 N6 O44 Zr12)

Multiplicity: 1

span 1 {1 1 1}