Structure 4112911

4112910 << 4112911 >> 4112912
Original COD entry Download CIF Download DOT

Citation: Kenneth Hanson; Nathalie Calin; Daniel Bugaris; Michael Scancella; Slavi C. Sevov (2004). Reversible Repositioning of Zinc Atoms within Single Crystals of a Zinc Polycarboxylate with an Open-Framework Structure. Journal of the American Chemical Society, 126, pp. 10502-10503.

Formula: C8 H4 Co2 O10

Chemical name: Co2[C4H4O(COO)4](H2O)

Cell parameters:

  • a = 20.2730(10) Å
  • b = 20.2730(10) Å
  • c = 20.2730(10) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

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: C192 H96 Co48 O240 (C4 H2 Co O5)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 7, 11, 12, 21, 35, 39, 58, 74
  • 1, 3, 7, 11, 12, 21, 35, 39, 58, 75
  • 1, 3, 8, 9, 16, 23, 27, 40, 62, 77
  • 1, 3, 8, 9, 16, 23, 27, 40, 62, 78
  • 2, 6, 7, 15, 22, 34, 35, 39, 63, 114
  • 2, 6, 8, 17, 23, 34, 38, 51, 60, 105
  • 2, 6, 8, 17, 23, 34, 38, 51, 60, 106
  • 2, 7, 8, 15, 17, 30, 38, 55, 60, 83
  • 2, 7, 8, 15, 17, 30, 38, 55, 60, 84
  • 2, 7, 9, 16, 18, 28, 31, 53, 65, 91
  • 2, 7, 9, 16, 18, 28, 31, 53, 66, 96
  • 2, 9, 8, 12, 20, 38, 30, 44, 64, 107
  • 3, 5, 12, 13, 20, 30, 51, 48, 58, 90
  • 3, 5, 12, 13, 20, 30, 51, 48, 58, 91
  • 3, 5, 14, 14, 19, 28, 42, 46, 70, 99
  • 3, 5, 14, 14, 19, 28, 42, 46, 71, 104
  • 3, 11, 9, 12, 20, 38, 40, 52, 79, 102
  • 4, 7, 11, 12, 21, 35, 39, 58, 74, 88
  • 4, 7, 11, 12, 21, 35, 39, 58, 75, 90
  • 4, 8, 9, 16, 23, 27, 40, 62, 77, 89
  • 4, 8, 9, 16, 23, 27, 40, 62, 78, 94
  • 5, 5, 11, 18, 34, 32, 32, 50, 98, 100
  • 6, 7, 12, 14, 28, 28, 46, 54, 81, 107
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