Structure 4330602

4330601 << 4330602 >> 4330603
Original COD entry Download CIF Download DOT

Citation: James J. Henkelis; Sarah A. Barnett; Lindsay P. Harding; Michaele J. Hardie (2012). Coordination Polymers Utilizing N-Oxide Functionalized Host Ligands. Inorganic Chemistry, 51, pp. 10657-10674.

Formula: C144 H180 B4 Cu2 F16 N18 O39

Chemical name: bis{2,7,12-trimethoxy-3,8,13-tris(4-N-oxide-pyridyloxy)-10,15-dihydro-5H-tribenzo[a,d,g]cyclononatriene}copper(II)monoaquotetra(N-methylpyrrolidone)copper(II) tetrafluoroborateN-methylpyrrolidone clathrate hydrate

Cell parameters:

  • a = 18.1713(19) Å
  • b = 21.487(2) Å
  • c = 24.177(2) Å
  • α = 84.788(4)°
  • β = 80.734(4)°
  • γ = 80.361(4)°

List type: noninterleaving

List: 2D

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;-1)

Dimensionality: 2

Formula: C168 H132 Cu2 N12 O48 (C84 H66 Cu N6 O24)

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