Structure 1569297

1569287 << 1569297 >> 1569356
Original COD entry Download CIF Download DOT

Citation: Takase, Masayoshi; Takata, Toranosuke; Oki, Kosuke; Mori, Shigeki; Uno, Hidemitsu (2023). Substituent effects on paratropicity and diatropicity in \p-extended hexapyrrolohexaazacoronene. Chemical Science, 14, pp. 7036-7043.

Formula: C72 H80 Cl6 F6 N7 O Sb

Cell parameters:

  • a = 15.9748(7) Å
  • b = 12.9194(4) Å
  • c = 34.5124(10) Å
  • α = 90°
  • β = 101.007(4)°
  • γ = 90°

List type: noninterleaving

List: 3D

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 0;1;0 0;0;1)

Dimensionality: 3

Formula: C352 H404 Cl72 N32 (C88 H101 Cl18 N8)

Multiplicity: 1

span 1 {1 1 1}