Structure 4116485

4116484 << 4116485 >> 4116486
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 = 4.9067(5) Å
  • b = 10.9054(9) Å
  • c = 11.8787(15) Å
  • α = 87.517(9)°
  • β = 86.25(1)°
  • γ = 83.147(8)°

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: C30 H24 N6 (C5 H4 N)

Multiplicity: 1

span 1 {1 1 1}