Structure 4133099

4133098 << 4133099 >> 4133135
Original COD entry Download CIF Download DOT

Citation: Duong, Thien D.; Sapchenko, Sergey A.; da Silva, Ivan; Godfrey, Harry G. W.; Cheng, Yongqiang; Daemen, Luke L.; Manuel, Pascal; Ramirez-Cuesta, Anibal J; Yang, Sihai; Schr\"oder, Martin (2018). Optimal Binding of Acetylene to a Nitro-Decorated Metal-Organic Framework.. Journal of the American Chemical Society, 140, pp. 16006-16009.

Formula: C28 H13 Cu2 N2 O14

Cell parameters:

  • a = 18.3933(6) Å
  • b = 18.3933(6) Å
  • c = 52.3346(18) Å
  • α = 90°
  • β = 90°
  • γ = 120°

List type: interleaving

List: 2D

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 3

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

Dimensionality: 2

Formula: C84 H38 Cu6 O30 (C42 H19 Cu3 O15)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 3

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

Dimensionality: 2

Formula: C66 H26 Cu6 O30 (C33 H13 Cu3 O15)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 2, entity 3 of 3

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

Dimensionality: 2

Formula: C66 H26 Cu6 O30 (C33 H13 Cu3 O15)

Multiplicity: 1

span 1 {1 1 1}