Structure 4116486

4116485 << 4116486 >> 4116492
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 = 4.9052(3) Å
  • b = 10.921(1) Å
  • c = 11.833(2) Å
  • α = 87.908(11)°
  • β = 86.45(1)°
  • γ = 83.132(7)°

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}