Structure 7124223

7124157 << 7124223 >> 7124224
Original COD entry Download CIF Download DOT

Citation: Drake, Hannah; Day, Gregory S.; Vali, Shaik Waseem; Xiao, Zhifeng; Banerjee, Sayan; Li, Jialuo; Joseph, Elizabeth; Kuszynski, Jason E.; Perry, Zachary; Kirchon, Angelo; Ozdemir, Osman; Lindahl, Paul; Zhou, Hong-Cai (2019). The Thermally Induced Decarboxylation Mechanism of a Mixed-Oxidation State Carboxylate-Based Iron Metal-Organic Framework. Chemical Communications, , pp. -.

Formula: C48 H29.64 Fe6 N6 O31.82

Chemical name: catena-[hexakis(m-5,5'-((E)-diazenediyl)bis(benzene-1,3-dicarboxylato))-tetrakis(m-oxo)-dodeca-aqua-dodeca-iron unknown solvate]

Cell parameters:

  • a = 21.9389(7) Å
  • b = 21.9389(7) Å
  • c = 21.9389(7) 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: C192 H120 Fe24 N24 O128 (C24 H15 Fe3 N3 O16)

Multiplicity: 1

span 1 {1 1 1}