Structure 4333580

4333578 << 4333580 >> 4333581
Original COD entry Download CIF Download DOT

Citation: Ganna A. Senchyk; Andrey B. Lysenko; Harald Krautscheid; Eduard B. Rusanov; Alexander N. Chernega; Karl W. Kr\"amer; Shi-Xia Liu; Silvio Decurtins; Konstantin V. Domasevitch (2013). Functionalized Adamantane Tectons Used in the Design of Mixed-Ligand Copper(II) 1,2,4-Triazolyl/Carboxylate Metal-Organic Frameworks. Inorganic Chemistry, 52, pp. 863-872.

Formula: C56 H74 Cu4 N12 O23

Chemical name: Bis(\m~3~-hydroxido)-bis(1-Carboxy-3,5,7-adamantanetricarboxylato)-1,3-bi(1,2,4-triazol-4-yl)adamantane diaquatetracopper(II) Trihydrate

Cell parameters:

  • a = 11.3853(4) Å
  • b = 12.0558(4) Å
  • c = 23.4951(9) Å
  • α = 93.417(2)°
  • β = 97.951(2)°
  • γ = 109.364(2)°

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 2

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

Dimensionality: 2

Formula: C56 H68 Cu4 N12 O20 (C14 H17 Cu N3 O5)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: C56 H68 Cu4 N12 O20 (C14 H17 Cu N3 O5)

Multiplicity: 1

span 1 {1 1 1}