Structure 7229781

7229761 << 7229781 >> 7229782
Original COD entry Download CIF Download DOT

Citation: Seth, Saikat Kumar; Bauz\'a, Antonio; Frontera, Antonio (2018). Screening polymorphism in a Ni(ii) metal--organic framework: experimental observations, Hirshfeld surface analyses and DFT studies. CrystEngComm, 20, pp. 746-.

Formula: C4 H9 N Ni O6

Cell parameters:

  • a = 10.2118(4) Å
  • b = 10.4135(5) Å
  • c = 13.6583(6) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

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 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C8 H18 N2 Ni2 O12 (C4 H9 N Ni O6)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C8 H18 N2 Ni2 O12 (C4 H9 N Ni O6)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C8 H18 N2 Ni2 O12 (C4 H9 N Ni O6)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C8 H18 N2 Ni2 O12 (C4 H9 N Ni O6)

Multiplicity: 1

span 1 {1 1 1}