Structure 7158405

7158246 << 7158405 >> 7159705
Original COD entry Download CIF Download DOT

Citation: McCarney, Eoin P.; McCarthy, William J.; Lovitt, June I.; Gunnlaugsson, Thorfinnur (2021). Macrocyclic vs. [2]catenane btp structures: influence of (aryl) substitution on the self templation of btp ligands in macrocyclic synthesis.. Organic & biomolecular chemistry, 19, pp. 10189-10200.

Formula: C30 H28 N9 O3

Cell parameters:

  • a = 4.8236(2) Å
  • b = 23.2321(13) Å
  • c = 25.2997(15) Å
  • α = 90°
  • β = 90.640(4)°
  • γ = 90°

List type: interleaving

List: 1D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 4, entity 5 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C4 H12 O4 (C H3 O)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 5, entity 6 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C4 H12 O4 (C H3 O)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 6, entity 7 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C4 H12 O4 (C H3 O)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 7, entity 8 of 4

Basis: (1;0;0)

Dimensionality: 1

Formula: C4 H12 O4 (C H3 O)

Multiplicity: 1

span 1 {1 1 1}