Structure 4346596

4346574 << 4346596 >> 4346598
Original COD entry Download CIF Download DOT

Citation: Tamm, Nadezhda B.; Troyanov, Sergey I. (2015). New Isolated-Pentagon-Rule Isomer of C92 Isolated as Trifluoromethyl and Chlorido Derivatives: C92(38)(CF3)14/16 and C92(38)Cl20/22.. Inorganic chemistry, 54, pp. 10527-10529.

Formula: C122.25 H20.35 F42

Cell parameters:

  • a = 13.8110(10) Å
  • b = 13.8980(10) Å
  • c = 24.1680(10) Å
  • α = 83.887(3)°
  • β = 85.006(8)°
  • γ = 62.648(6)°

List type: noninterleaving

List: 1D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 2, entity 3 of 1

Basis: (1;0;0)

Dimensionality: 1

Formula: C33 (C)

Multiplicity: 1

Coordination sequences:

  • 2, 3, 6, 7, 6, 5, 2, 2, 2, 3
  • 2, 4, 5, 6, 7, 4, 3, 2, 3, 4
  • 2, 5, 6, 3, 5, 4, 4, 4, 4, 4
  • 3, 4, 5, 3, 3, 4, 5, 5, 5, 5
  • 3, 4, 5, 6, 5, 4, 4, 2, 2, 4
  • 3, 5, 4, 3, 3, 4, 5, 5, 5, 5
  • 3, 6, 4, 2, 2, 3, 5, 7, 7, 5
  • 3, 6, 5, 3, 4, 4, 4, 4, 4, 4
  • 4, 4, 4, 5, 4, 5, 4, 4, 4, 5
  • 4, 6, 3, 2, 2, 3, 5, 7, 7, 5
  • 4, 6, 5, 2, 2, 4, 4, 6, 6, 4
  • 4, 7, 3, 3, 2, 4, 4, 6, 6, 4
  • 5, 5, 4, 2, 3, 4, 6, 6, 6, 4
  • 5, 6, 4, 2, 2, 2, 6, 6, 6, 6
  • 6, 6, 2, 2, 2, 4, 6, 8, 6, 4
  • 6, 6, 3, 2, 2, 4, 4, 6, 6, 4
  • 7, 5, 3, 2, 2, 2, 6, 6, 6, 6
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