Structure 4314828

4314815 << 4314828 >> 4314833
Original COD entry Download CIF Download DOT

Citation: J. Jornet-Somoza; M. Deumal; M. A. Robb; C. P. Landee; M. M. Turnbull; R. Feyerherm; J. J. Novoa (2010). First-Principles Bottom-Up Study of 1D to 3D Magnetic Transformation in the Copper Pyrazine Dinitrate S=1/2 Antiferromagnetic Crystal. Inorganic Chemistry, 49, pp. 1750-1760.

Formula: C4 H4 Cu N4 O6

Cell parameters:

  • a = 6.69166(12) Å
  • b = 5.10538(8) Å
  • c = 11.60022(18) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

List: 1D

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 2

Basis: (1;0;0)

Dimensionality: 1

Formula: C4 H4 Cu N4 O6 (C4 H4 Cu N4 O6)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (1;0;0)

Dimensionality: 1

Formula: C4 H4 Cu N4 O6 (C4 H4 Cu N4 O6)

Multiplicity: 1

span 1 {1 1 1}