Structure 4347230

4347215 << 4347230 >> 4347231
Original COD entry Download CIF Download DOT

Citation: Kobalz, Merten; Lincke, J\"org; Kobalz, Karolin; Erhart, Oliver; Bergmann, Jens; L\"assig, Daniel; Lange, Marcus; M\"ollmer, Jens; Gl\"aser, Roger; Staudt, Reiner; Krautscheid, Harald (2016). Paddle Wheel Based Triazolyl Isophthalate MOFs: Impact of Linker Modification on Crystal Structure and Gas Sorption Properties.. Inorganic chemistry, 55, pp. 3030-3039.

Formula: C20 H10 Cu2 N6 O8

Cell parameters:

  • a = 10.968(2) Å
  • b = 12.2031(14) Å
  • c = 14.366(2) Å
  • α = 90.00°
  • β = 110.304(13)°
  • γ = 90.00°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
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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 H20 Cu4 N12 O16 (C10 H5 Cu N3 O4)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 4, 9, 12, 11, 15, 34, 28
  • 1, 2, 4, 7, 5, 18, 18, 19, 25, 41
  • 1, 2, 4, 7, 7, 11, 14, 26, 23, 35
  • 1, 2, 4, 7, 7, 11, 14, 26, 23, 36
  • 1, 2, 4, 8, 13, 9, 16, 22, 30, 37
  • 2, 4, 7, 11, 10, 14, 23, 18, 40, 38
  • 2, 7, 11, 12, 14, 21, 21, 31, 37, 50
  • 2, 7, 11, 12, 14, 21, 21, 31, 38, 50
  • 2, 7, 11, 12, 14, 21, 21, 31, 38, 53
  • 3, 3, 4, 9, 12, 11, 15, 34, 28, 39
  • 3, 4, 7, 5, 18, 18, 19, 25, 41, 39
  • 3, 4, 7, 7, 11, 14, 26, 23, 35, 41
  • 3, 4, 7, 7, 11, 14, 26, 23, 36, 44
  • 3, 4, 8, 13, 9, 16, 22, 30, 37, 40
  • 3, 4, 12, 10, 14, 16, 25, 29, 38, 41
  • 3, 4, 12, 10, 14, 16, 25, 29, 39, 44
  • 3, 6, 5, 8, 14, 10, 27, 32, 31, 41
  • 3, 6, 5, 13, 13, 18, 22, 34, 32, 45
  • 3, 6, 5, 13, 13, 18, 22, 34, 33, 47
  • 3, 6, 7, 6, 9, 25, 20, 29, 37, 43
  • 3, 8, 11, 8, 15, 21, 19, 28, 42, 52
  • 6, 11, 9, 13, 20, 18, 27, 32, 44, 59
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