Structure 7209645

7209644 << 7209645 >> 7209646
Original COD entry Download CIF Download DOT

Citation: Jin, Hongjian; Plonka, Anna M.; Parise, John B.; Goroff, Nancy S. (2013). Pressure induced topochemical polymerization of diiodobutadiyne: a single-crystal-to-single-crystal transformation. CrystEngComm, 15, pp. 3106-.

Formula: C18 H14 I2 N4 O2

Cell parameters:

  • a = 4.9330(3) Å
  • b = 8.4214(5) Å
  • c = 12.3642(8) Å
  • α = 100.542(5)°
  • β = 82.986(5)°
  • γ = 97.144(5)°

List type: noninterleaving

List: 1D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 1, entity 2 of 1

Basis: (1;0;0)

Dimensionality: 1

Formula: C4 I2 (C2 I)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 3, 2, 3, 4, 3, 2, 3, 4
  • 2, 3, 4, 3, 2, 3, 4, 3, 2, 3
  • 3, 3, 2, 3, 4, 3, 2, 3, 4, 3
span 1 {1 1 1}