Structure 4317145

4317144 << 4317145 >> 4317158
Original COD entry Download CIF Download DOT

Citation: Jinwoo Seo; Narae Jin; Hyungphil Chun (2010). Topologies of Metal-Organic Frameworks Based on Pyrimidine-5-carboxylate and Unexpected Gas-Sorption Selectivity for CO2. Inorganic Chemistry, 49, pp. 10833-10839.

Formula: C10 H6 Cu N4 O4

Chemical name: ?

Cell parameters:

  • a = 21.593(3) Å
  • b = 21.593(3) Å
  • c = 7.7402(13) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 120.00°

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: C90 H54 Cu9 N36 O36 (C10 H6 Cu N4 O4)

Multiplicity: 2

Coordination sequences:

  • 1, 2, 3, 5, 2, 6, 9, 18, 12, 21
  • 1, 2, 3, 6, 5, 10, 7, 14, 10, 21
  • 1, 2, 3, 7, 7, 14, 10, 18, 10, 21
  • 1, 2, 4, 8, 5, 11, 11, 21, 11, 21
  • 2, 4, 3, 6, 5, 11, 11, 21, 11, 21
  • 2, 5, 7, 14, 8, 14, 8, 18, 20, 39
  • 3, 3, 5, 2, 6, 9, 18, 12, 21, 9
  • 3, 3, 6, 5, 10, 7, 14, 10, 21, 19
  • 3, 3, 7, 7, 14, 10, 18, 10, 21, 19
  • 3, 4, 8, 5, 11, 11, 21, 11, 21, 17
  • 3, 6, 3, 7, 9, 18, 12, 21, 9, 21
  • 3, 7, 6, 11, 7, 14, 10, 21, 19, 36
  • 4, 6, 12, 8, 14, 6, 14, 18, 36, 24
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