Structure 4119177

4119176 << 4119177 >> 4119195
Original COD entry Download CIF Download DOT

Citation: Liting Du; Zhiyong Lu; Kaiyuan Zheng; Junyi Wang; Xin Zheng; Yi Pan; Xiaozeng You; Junfeng Bai (2013). Fine-Tuning Pore Size by Shifting Coordination Sites of Ligands and Surface Polarization of Metal-Organic Frameworks To Sharply Enhance the Selectivity for CO2. Journal of the American Chemical Society, 135, pp. 562-565.

Formula: C15 H15 Cu N3 O6

Chemical name: ?

Cell parameters:

  • a = 10.908(7) Å
  • b = 12.434(8) Å
  • c = 14.354(9) Å
  • α = 90.00°
  • β = 107.495(7)°
  • 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: C48 H24 Cu4 N8 O16 (C12 H6 Cu N2 O4)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 5, 5, 8, 14, 10, 28, 32
  • 1, 2, 3, 8, 10, 8, 16, 21, 20, 28
  • 1, 2, 4, 7, 5, 18, 18, 24, 26, 45
  • 1, 2, 4, 7, 7, 12, 15, 28, 23, 40
  • 1, 2, 4, 7, 7, 12, 15, 28, 23, 41
  • 1, 2, 4, 10, 13, 9, 17, 22, 31, 37
  • 2, 4, 3, 8, 13, 9, 17, 22, 31, 37
  • 2, 7, 11, 13, 15, 22, 22, 32, 38, 55
  • 2, 7, 11, 13, 15, 22, 22, 32, 39, 55
  • 2, 7, 11, 13, 15, 22, 22, 32, 39, 58
  • 3, 3, 5, 5, 8, 14, 10, 28, 32, 36
  • 3, 3, 8, 10, 8, 16, 21, 20, 28, 42
  • 3, 4, 7, 5, 18, 18, 24, 26, 45, 39
  • 3, 4, 7, 7, 12, 15, 28, 23, 40, 41
  • 3, 4, 7, 7, 12, 15, 28, 23, 41, 44
  • 3, 4, 10, 13, 9, 17, 22, 31, 37, 45
  • 3, 4, 12, 10, 16, 16, 28, 30, 40, 41
  • 3, 4, 12, 10, 16, 16, 28, 30, 41, 44
  • 3, 6, 5, 13, 13, 21, 23, 38, 32, 48
  • 3, 6, 5, 13, 13, 21, 23, 38, 33, 50
  • 3, 6, 6, 9, 14, 10, 28, 32, 36, 41
  • 3, 6, 7, 7, 10, 25, 20, 34, 37, 48
  • 3, 9, 11, 9, 16, 21, 20, 28, 42, 56
  • 6, 11, 10, 14, 21, 19, 27, 32, 48, 63
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