Structure 7123317

7123315 << 7123317 >> 7123318
Original COD entry Download CIF Download DOT

Citation: Sindt, Ammon J.; Smith, Mark D.; Berens, Samuel; Vasenkov, Sergey; Bowers, Clifford; Shimizu, Linda S. (2019). Single-crystal-to-single-crystal guest exchange in columnar assembled brominated triphenylamine bis-urea macrocycles. Chemical Communications, , pp. -.

Formula: C45.38 H39.38 Br2 N6 O2

Cell parameters:

  • a = 15.8777(5) Å
  • b = 4.6345(2) Å
  • c = 26.7173(8) Å
  • α = 90°
  • β = 99.975(2)°
  • 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 2

Basis: (0;1;0)

Dimensionality: 1

Formula: C6 H6 (C H)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 5, entity 6 of 2

Basis: (0;1;0)

Dimensionality: 1

Formula: C6 H6 (C H)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 4, 5, 5, 4, 6, 6, 4, 4
  • 2, 3, 6, 7, 5, 4, 4, 5, 6, 5
  • 3, 4, 5, 5, 4, 6, 6, 4, 4, 4
  • 3, 5, 5, 4, 5, 5, 5, 5, 4, 5
span 1 {1 1 1}