Structure 1549539

1549537 << 1549539 >> 1549540
Original COD entry Download CIF Download DOT

Citation: K\"oferstein, Roberto; Robl, Christian (2014). Synthesis, Crystal Structure, Hydrogen Bonding, and Thermal Behavior of a Three-Dimensional CuII-benzene-1,2,4,5-tetracarboxylate Templated by 1,9-Diaminononane. Zeitschrift f\"ur anorganische und allgemeine Chemie, 640, pp. 1937-.

Formula: C29 H40 Cu4 N2 O23

Cell parameters:

  • a = 10.575(2) Å
  • b = 11.660(2) Å
  • c = 15.767(2) Å
  • α = 106.08(1)°
  • β = 90.73(2)°
  • γ = 94.05(1)°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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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: C40 H12 Cu8 O36 (C10 H3 Cu2 O9)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 11, 16, 16, 24, 42, 48, 51
  • 1, 2, 4, 7, 8, 20, 40, 42, 38, 47
  • 1, 2, 4, 7, 9, 24, 45, 41, 36, 50
  • 2, 6, 12, 13, 12, 24, 34, 36, 44, 54
  • 2, 9, 12, 16, 15, 24, 39, 45, 60, 64
  • 2, 9, 12, 16, 15, 25, 41, 48, 52, 65
  • 2, 9, 12, 16, 15, 25, 42, 47, 53, 66
  • 2, 9, 13, 15, 15, 25, 42, 46, 52, 64
  • 2, 9, 16, 11, 16, 22, 39, 47, 55, 65
  • 2, 9, 16, 11, 16, 23, 43, 50, 52, 58
  • 2, 9, 16, 11, 16, 23, 44, 49, 52, 60
  • 3, 3, 11, 16, 16, 24, 42, 48, 51, 62
  • 3, 4, 7, 8, 20, 40, 42, 38, 47, 68
  • 3, 4, 7, 9, 24, 45, 41, 36, 50, 70
  • 3, 4, 14, 17, 12, 22, 41, 57, 52, 57
  • 3, 4, 14, 17, 13, 26, 45, 54, 52, 55
  • 3, 4, 14, 18, 13, 27, 46, 53, 51, 57
  • 3, 6, 6, 12, 25, 34, 36, 44, 56, 63
  • 3, 6, 7, 14, 22, 28, 43, 48, 52, 58
  • 3, 6, 7, 15, 26, 32, 42, 47, 54, 63
  • 3, 6, 7, 15, 27, 33, 40, 47, 54, 63
  • 4, 12, 12, 9, 16, 30, 39, 33, 45, 65
  • 8, 12, 13, 12, 24, 34, 36, 44, 54, 95
  • 8, 16, 8, 13, 22, 35, 38, 40, 54, 85
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