Structure 1529093

1529092 << 1529093 >> 1529094
Original COD entry Download CIF Download DOT

Citation: Thorp-Greenwood, Flora L.; Ronson, Tanya K.; Hardie, Michaele J. (2015). Copper coordination polymers from cavitand ligands: hierarchical spaces from cage and capsule motifs, and other topologies. Chem. Sci., 6, pp. 5779-.

Formula: C149 H187 B4 Cu2 F16 N19 O34.5

Chemical name: tris(isonicotonoyl)cyclotriguaiacyclene copper(II) tetrafluoroborate

Cell parameters:

  • a = 28.9123(10) Å
  • b = 20.7706(8) Å
  • c = 29.7284(13) Å
  • α = 90.00°
  • β = 101.224(4)°
  • γ = 90.00°

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: C198 H186 Cu4 N18 O46 (C99 H93 Cu2 N9 O23)

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: C198 H186 Cu4 N18 O46 (C99 H93 Cu2 N9 O23)

Multiplicity: 1

span 1 {1 1 1}