Structure 7202205

7202204 << 7202205 >> 7202206
Original COD entry Download CIF Download DOT

Citation: Smart, Paul; Espallargas, Guillermo M\'inguez; Brammer, Lee (2008). Competition between coordination network and halogen bond network formation: towards halogen-bond functionalised network materials using copper-iodobenzoate units. CrystEngComm, 10, pp. 1335-.

Formula: C78 H60 Cu3 I6 N6 O12

Cell parameters:

  • a = 13.3056(7) Å
  • b = 12.9652(7) Å
  • c = 23.8435(13) Å
  • α = 90.00°
  • β = 105.5180(10)°
  • γ = 90.00°

List type: interleaving

List: 1D

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 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C76 H64 Cu2 I4 N8 O8 (C38 H32 Cu I2 N4 O4)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C76 H64 Cu2 I4 N8 O8 (C38 H32 Cu I2 N4 O4)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C26 H20 Cu I2 N2 O4 (C26 H20 Cu I2 N2 O4)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C26 H20 Cu I2 N2 O4 (C26 H20 Cu I2 N2 O4)

Multiplicity: 1

span 1 {1 1 1}