Structure 4116481

4116448 << 4116481 >> 4116482
Original COD entry Download CIF Download DOT

Citation: James L. Foley; Lian Li; Daniel J. Sandman; Michael J. Vela; Bruce M. Foxman; Rick Albro; Craig J. Eckhardt (1999). Side Group Interactions in a Polydiacetylene Single Crystal. Journal of the American Chemical Society, 121, pp. 7262-7263.

Formula: C15 H12 N3

Cell parameters:

  • a = 4.935(2) Å
  • b = 10.861(7) Å
  • c = 12.373(12) Å
  • α = 82.77(7)°
  • β = 83.84(7)°
  • γ = 83.25(5)°

List type: noninterleaving

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 1

Basis: (1;0;0)

Dimensionality: 1

Formula: C32 H24 N6 (C16 H12 N3)

Multiplicity: 1

span 1 {1 1 1}