Structure 4313272

4313271 << 4313272 >> 4313273
Original COD entry Download CIF Download DOT

Citation: T. J. Prior; M. J. Rosseinsky (2003). Chiral Direction and Interconnection of Helical Three-Connected Networks in Metal-Organic Frameworks. Inorganic Chemistry, 42, pp. 1564-1575.

Formula: C60 H18 N6 Ni3 O18

Chemical name: Ni3(btc)2(py)6(R-phenylethanediol)3

Cell parameters:

  • a = 28.718(2) Å
  • b = 28.718(2) Å
  • c = 28.718(2) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

List type: interleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
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Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 2

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: C264 H72 N24 Ni12 O72 (C22 H6 N2 Ni O6)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: C264 H72 N24 Ni12 O72 (C22 H6 N2 Ni O6)

Multiplicity: 1

span 1 {1 1 1}