Structure 4035759

4035345 << 4035759 >> 4035766
Original COD entry Download CIF Download DOT

Citation: Molina-Muriel, Ricardo; Aragay, Gemma; Escudero-Ad\'an, Eduardo C; Ballester, Pablo (2018). Switching from Negative-Cooperativity to No-Cooperativity in the Binding of Ion-Pair Dimers by a Bis(calix[4]pyrrole) Macrocycle.. The Journal of organic chemistry, 83, pp. 13507-13514.

Formula: C145.6 H196.4 Cl2 F5.2 N16

Cell parameters:

  • a = 12.5876(2) Å
  • b = 22.9066(4) Å
  • c = 24.9791(4) Å
  • α = 106.2095(14)°
  • β = 90.5433(13)°
  • γ = 95.2728(13)°

List type: interleaving

List: 1D

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)

Dimensionality: 1

Formula: C93 H174 F6 N3 (C31 H58 F2 N)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (1;0;0)

Dimensionality: 1

Formula: C93 H174 F6 N3 (C31 H58 F2 N)

Multiplicity: 1

span 1 {1 1 1}