Structure 2022083

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Citation: Koenigsmann, Christopher; Rachid, Leena N.; Sheedy, Christina M.; Corfield, Peter W. R. (2020). Synthesis, decomposition studies and crystal structure of a three-dimensional CuCN network structure with protonated N-methylethanolamine as the guest cation. Acta Crystallographica Section C, 76, pp. -.

Formula: C6 H10 Cu2 N4 O

Chemical name: Poly[2-hydroxy-<i>N</i>-methylethan-1-aminium [\m~3~-cyanido-\k^3^<i>C</i>:<i>C</i>:<i>N</i>-di-\m-cyanido-\k^4^<i>C</i>:<i>N</i>-dicuprate(I)]]

Cell parameters:

  • a = 8.8994(5) Å
  • b = 8.8994(5) Å
  • c = 11.3750(11) 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: C12 Cu8 N12 (C3 Cu2 N3)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 9, 11, 16, 32, 41, 49, 78, 107
  • 2, 5, 8, 10, 20, 33, 37, 52, 91, 93
  • 2, 5, 9, 10, 18, 34, 40, 51, 90, 98
  • 2, 5, 9, 10, 18, 35, 41, 49, 90, 102
  • 2, 5, 10, 10, 16, 38, 39, 42, 94, 109
  • 3, 6, 8, 11, 25, 31, 39, 70, 90, 88
  • 4, 6, 7, 15, 26, 26, 50, 75, 80, 94
  • 5, 6, 6, 17, 29, 25, 51, 88, 75, 91
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