Structure 4128748

4128747 << 4128748 >> 4128767
Original COD entry Download CIF Download DOT

Citation: Widmer, Remo N.; Lampronti, Giulio I.; Chibani, Siwar; Wilson, Craig W.; Anzellini, Simone; Farsang, Stefan; Kleppe, Annette K.; Casati, Nicola P. M.; MacLeod, Simon G.; Redfern, Simon A. T.; Coudert, Fran\,cois-Xavier; Bennett, Thomas D. (2019). Rich Polymorphism of a Metal-Organic Framework in Pressure-Temperature Space.. Journal of the American Chemical Society, 141, pp. 9330-9337.

Formula: C6 H6 N4 Zn

Chemical name: catena-(tetrakis(&#x00CE;&#x00BC;2-Imidazolato-N,N')-di-zinc(ii) clathrate)

Cell parameters:

  • a = 14.56659 Å
  • b = 14.44478 Å
  • c = 15.45102 Å
  • α = 90°
  • β = 90°
  • γ = 90°

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: C96 H96 N64 Zn16 (C6 H6 N4 Zn)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 4, 5, 9, 18, 18, 15, 27, 51
  • 1, 2, 4, 5, 9, 18, 18, 15, 27, 54
  • 1, 2, 4, 8, 12, 24, 12, 18, 35, 67
  • 1, 2, 4, 8, 12, 24, 12, 18, 36, 72
  • 3, 4, 5, 9, 18, 18, 15, 27, 51, 49
  • 3, 4, 5, 9, 18, 18, 15, 27, 54, 53
  • 3, 4, 8, 12, 24, 12, 18, 35, 67, 32
  • 3, 4, 8, 12, 24, 12, 18, 36, 72, 34
  • 3, 7, 8, 15, 12, 21, 24, 44, 33, 56
  • 3, 7, 8, 15, 12, 21, 24, 45, 35, 59
  • 4, 8, 16, 8, 12, 24, 48, 23, 32, 64
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