Structure 4101942

4101941 << 4101942 >> 4101943
Original COD entry Download CIF Download DOT

Citation: Pradip Bag; Mikhail E. Itkis; Sushanta K. Pal; Bruno Donnadieu; Fook S. Tham; Hyunsoo Park; John A. Schlueter; Theo Siegrist; Robert C. Haddon (2010). Resonating Valence Bond and \s-Charge Density Wave Phases in a Benzannulated Phenalenyl Radical. Journal of the American Chemical Society, 132, pp. 2684-2694.

Formula: C48 H32 B N2 O2

Chemical name: ?

Cell parameters:

  • a = 10.0955(3) Å
  • b = 19.2247(6) Å
  • c = 17.2688(6) Å
  • α = 90.00°
  • β = 98.9312(5)°
  • γ = 90.00°

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: (0;0;1)

Dimensionality: 1

Formula: C108 H72 B2 N4 O4 (C54 H36 B N2 O2)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C108 H72 B2 N4 O4 (C54 H36 B N2 O2)

Multiplicity: 1

span 1 {1 1 1}