Structure 1550138

1550137 << 1550138 >> 1550164
Original COD entry Download CIF Download DOT

Citation: Ding, Bowen; Hua, Carol; Kepert, Cameron J.; D'Alessandro, Deanna Michelle (2019). Influence of Structure-Activity Relationships on Through-Space Intervalence Charge Transfer in Metal-Organic Frameworks with Cofacial Redox-Active Units. Chemical Science, , pp. -.

Formula: C64 H36 N8 O8 S4 Se2 Zn2

Cell parameters:

  • a = 25.811(5) Å
  • b = 18.453(4) Å
  • c = 15.943(3) Å
  • α = 90°
  • β = 90.91(3)°
  • γ = 90°

List type: interleaving

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 2

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: C128 H72 N24 O16 S16 Se4 Zn4 (C32 H18 N6 O4 S4 Se Zn)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: C128 H72 N24 O16 S16 Se4 Zn4 (C32 H18 N6 O4 S4 Se Zn)

Multiplicity: 1

span 1 {1 1 1}