Structure 1513076

1513030 << 1513076 >> 1513087
Original COD entry Download CIF Download DOT

Citation: Daniel L. Reger; Agota Debreczeni; Mark D. Smith (2012). Synthesis and structure of a Cu4O4 cubane core complex from a carboxylate ligand containing a strong pi pi stacking supramolecular synthon. Inorganica Chimica Acta, 386, pp. 102-108.

Formula: C81 H74 Cu4 N6 O21

Chemical name: ?

Cell parameters:

  • a = 28.108(4) Å
  • b = 27.934(4) Å
  • c = 28.988(4) Å
  • α = 90.00°
  • β = 115.139(3)°
  • γ = 90.00°

List type: interleaving

List: 1D

Combined 3D structure and graph

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Molecules

CIF datablock 0, entity 1 of 4

Basis: (1;0;1)

Dimensionality: 1

Formula: C194 H170 Cu8 N14 O50 (C97 H85 Cu4 N7 O25)

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CIF datablock 1, entity 2 of 4

Basis: (1;0;1)

Dimensionality: 1

Formula: C194 H170 Cu8 N14 O50 (C97 H85 Cu4 N7 O25)

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (1;0;1)

Dimensionality: 1

Formula: C194 H170 Cu8 N14 O50 (C97 H85 Cu4 N7 O25)

span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (1;0;1)

Dimensionality: 1

Formula: C194 H170 Cu8 N14 O50 (C97 H85 Cu4 N7 O25)

span 1 {1 1 1}