Structure 7712204

7712196 << 7712204 >> 7712221
Original COD entry Download CIF Download DOT

Citation: Resendiz-Lara, Diego A; Rosas-Sá nchez, Alfredo; Hashizume, Daisuke; Barquera-Lozada, José E; Toscano, R. Alfredo; Ló pez-Corté s, José G; Ortega-Alfaro, M Carmen (2023). Synthesis of (μ2,η3-allyl-η5-oxapentadienyl)diiron pentacarbonyl complexes, an unusual reaction product from η4-(vinylketene)Fe(CO)3 complexes: structure and electron density distribution analysis.. Dalton transactions (Cambridge, England : 2003), 52, pp. 2722-2734.

Formula: C53 H39 F2 Fe4 O6

Cell parameters:

  • a = 18.2892(3) Å
  • b = 24.9311(5) Å
  • c = 10.3706(2) Å
  • α = 90°
  • β = 106.4467(7)°
  • γ = 90°

List type: interleaving

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 4, entity 5 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C24 H24 (C H)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 8, 8, 6, 10, 16, 14, 5, 3
  • 1, 4, 9, 8, 8, 9, 13, 11, 9, 6
  • 1, 5, 8, 8, 9, 10, 11, 10, 8, 9
  • 1, 5, 9, 9, 7, 14, 15, 10, 4, 5
  • 1, 6, 10, 11, 10, 8, 9, 10, 11, 10
  • 2, 4, 8, 8, 5, 10, 16, 14, 5, 3
  • 2, 6, 9, 7, 9, 12, 15, 9, 4, 8
  • 2, 6, 11, 7, 5, 14, 15, 10, 4, 5
  • 3, 4, 8, 8, 10, 12, 15, 9, 4, 8
  • 3, 6, 16, 14, 9, 6, 9, 13, 11, 9
  • 3, 7, 11, 9, 9, 13, 11, 9, 6, 9
  • 3, 10, 16, 14, 5, 3, 10, 16, 14, 5
  • 5, 8, 8, 6, 10, 16, 14, 5, 3, 10
  • 5, 9, 8, 8, 9, 13, 11, 9, 6, 9
  • 5, 9, 9, 10, 12, 15, 9, 4, 8, 12
  • 6, 8, 8, 5, 10, 16, 14, 5, 3, 10
  • 6, 8, 8, 9, 10, 11, 10, 8, 9, 10
  • 6, 9, 9, 7, 14, 15, 10, 4, 5, 14
  • 6, 9, 13, 11, 9, 6, 9, 13, 11, 9
  • 6, 12, 8, 5, 14, 15, 10, 4, 5, 14
  • 7, 10, 7, 9, 12, 15, 9, 4, 8, 12
  • 7, 10, 11, 10, 8, 9, 10, 11, 10, 8
  • 7, 11, 7, 8, 12, 15, 9, 4, 8, 12
  • 7, 12, 7, 5, 14, 15, 10, 4, 5, 14
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CIF datablock 5, entity 6 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C24 H24 (C H)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 8, 8, 6, 10, 16, 14, 5, 3
  • 1, 4, 9, 8, 8, 9, 13, 11, 9, 6
  • 1, 5, 8, 8, 9, 10, 11, 10, 8, 9
  • 1, 5, 9, 9, 7, 14, 15, 10, 4, 5
  • 1, 6, 10, 11, 10, 8, 9, 10, 11, 10
  • 2, 4, 8, 8, 5, 10, 16, 14, 5, 3
  • 2, 6, 9, 7, 9, 12, 15, 9, 4, 8
  • 2, 6, 11, 7, 5, 14, 15, 10, 4, 5
  • 3, 4, 8, 8, 10, 12, 15, 9, 4, 8
  • 3, 6, 16, 14, 9, 6, 9, 13, 11, 9
  • 3, 7, 11, 9, 9, 13, 11, 9, 6, 9
  • 3, 10, 16, 14, 5, 3, 10, 16, 14, 5
  • 5, 8, 8, 6, 10, 16, 14, 5, 3, 10
  • 5, 9, 8, 8, 9, 13, 11, 9, 6, 9
  • 5, 9, 9, 10, 12, 15, 9, 4, 8, 12
  • 6, 8, 8, 5, 10, 16, 14, 5, 3, 10
  • 6, 8, 8, 9, 10, 11, 10, 8, 9, 10
  • 6, 9, 9, 7, 14, 15, 10, 4, 5, 14
  • 6, 9, 13, 11, 9, 6, 9, 13, 11, 9
  • 6, 12, 8, 5, 14, 15, 10, 4, 5, 14
  • 7, 10, 7, 9, 12, 15, 9, 4, 8, 12
  • 7, 10, 11, 10, 8, 9, 10, 11, 10, 8
  • 7, 11, 7, 8, 12, 15, 9, 4, 8, 12
  • 7, 12, 7, 5, 14, 15, 10, 4, 5, 14
span 1 {1 1 1}