Structure 4101542

4101541 << 4101542 >> 4101546
Original COD entry Download CIF Download DOT

Citation: Dinca, Mircea; Yu, Anta F; Long, Jeffrey R (2006). Microporous metal-organic frameworks incorporating 1,4-benzeneditetrazolate: syntheses, structures, and hydrogen storage properties.. Journal of the American Chemical Society, 128, pp. 8904-8913.

Formula: C23 H8 Cu2 N18 O8

Chemical name: ?

Cell parameters:

  • a = 22.340(4) Å
  • b = 7.079(1) Å
  • c = 13.644(3) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

List type: interleaving

List: 1-3D

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 5

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

Dimensionality: 3

Formula: C56 H16 Cu4 N36 O4 (C14 H4 Cu N9 O)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 5

Basis: (0;1;0)

Dimensionality: 1

Formula: O6 (O)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 2, entity 3 of 5

Basis: (0;1;0)

Dimensionality: 1

Formula: O6 (O)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 3, entity 4 of 5

Basis: (0;1;0)

Dimensionality: 1

Formula: O6 (O)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}

CIF datablock 4, entity 5 of 5

Basis: (0;1;0)

Dimensionality: 1

Formula: O6 (O)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 2, 2, 2, 2, 2, 2, 2, 2
span 1 {1 1 1}