Structure 4509185

4509178 << 4509185 >> 4509201
Original COD entry Download CIF Download DOT

Citation: Konarev, Dmitri V.; Khasanov, Salavat S.; Saito, Gunzi; Lyubovskaya, Rimma N. (2009). Design of Molecular and Ionic Complexes of Fullerene C60with Metal(II) Octaethylporphyrins, MIIOEP (M = Zn, Co, Fe, and Mn) Containing Coordination M−N(ligand) and M−C(C60−) Bonds. Crystal Growth & Design, 9, pp. 1170-.

Formula: C108.3 H60.3 Cl1.4 N6.3 Zn

Chemical name: ?

Cell parameters:

  • a = 25.7070(11) Å
  • b = 17.4702(8) Å
  • c = 15.1678(6) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

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: C38 H26 Cl8 N2 (C19 H13 Cl4 N)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 12, 12, 9, 5, 9, 19, 21, 12
  • 2, 6, 11, 12, 6, 4, 9, 16, 15, 16
  • 2, 8, 13, 10, 6, 5, 9, 19, 21, 12
  • 3, 7, 11, 11, 7, 5, 9, 19, 21, 12
  • 3, 7, 12, 10, 7, 5, 9, 19, 21, 12
  • 3, 7, 12, 11, 5, 5, 11, 18, 21, 13
  • 3, 7, 13, 12, 7, 7, 13, 12, 10, 13
  • 3, 7, 13, 24, 18, 7, 2, 3, 7, 13
  • 3, 7, 14, 17, 18, 10, 6, 5, 7, 15
  • 3, 8, 12, 10, 5, 5, 11, 18, 21, 13
  • 3, 8, 12, 10, 6, 5, 9, 19, 21, 12
  • 3, 9, 13, 12, 10, 13, 11, 8, 7, 13
  • 4, 6, 12, 10, 7, 5, 9, 19, 21, 12
  • 4, 6, 12, 11, 5, 5, 11, 18, 21, 13
  • 4, 7, 14, 13, 10, 13, 10, 6, 8, 14
  • 4, 9, 16, 15, 16, 10, 4, 4, 9, 16
  • 5, 6, 12, 10, 5, 5, 11, 18, 21, 13
  • 5, 14, 13, 5, 3, 7, 13, 24, 18, 7
  • 5, 14, 13, 7, 5, 9, 19, 21, 12, 5
  • 6, 7, 15, 16, 15, 10, 6, 5, 7, 15
  • 6, 12, 12, 9, 5, 9, 19, 21, 12, 5
  • 6, 13, 12, 6, 4, 9, 16, 15, 16, 10
  • 6, 13, 12, 10, 8, 13, 12, 10, 13, 11
  • 6, 14, 11, 9, 8, 14, 13, 10, 13, 10
  • 6, 16, 11, 5, 5, 7, 15, 16, 15, 10
  • 6, 16, 11, 5, 5, 11, 18, 21, 13, 4
  • 7, 15, 10, 7, 5, 9, 19, 21, 12, 5
  • 7, 15, 11, 5, 5, 11, 18, 21, 13, 4
  • 7, 16, 11, 6, 8, 14, 13, 10, 13, 10
  • 9, 12, 11, 7, 5, 9, 19, 21, 12, 5
  • 9, 13, 11, 5, 5, 11, 18, 21, 13, 4
  • 9, 13, 12, 8, 7, 13, 12, 10, 13, 11
  • 10, 12, 10, 7, 5, 9, 19, 21, 12, 5
  • 10, 12, 11, 5, 5, 11, 18, 21, 13, 4
  • 10, 14, 10, 6, 8, 14, 13, 10, 13, 10
span 1 {1 1 1}

CIF datablock 5, entity 6 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C38 H26 Cl8 N2 (C19 H13 Cl4 N)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 12, 12, 9, 5, 9, 19, 21, 12
  • 2, 6, 11, 12, 6, 4, 9, 16, 15, 16
  • 2, 8, 13, 10, 6, 5, 9, 19, 21, 12
  • 3, 7, 11, 11, 7, 5, 9, 19, 21, 12
  • 3, 7, 12, 10, 7, 5, 9, 19, 21, 12
  • 3, 7, 12, 11, 5, 5, 11, 18, 21, 13
  • 3, 7, 13, 12, 7, 7, 13, 12, 10, 13
  • 3, 7, 13, 24, 18, 7, 2, 3, 7, 13
  • 3, 7, 14, 17, 18, 10, 6, 5, 7, 15
  • 3, 8, 12, 10, 5, 5, 11, 18, 21, 13
  • 3, 8, 12, 10, 6, 5, 9, 19, 21, 12
  • 3, 9, 13, 12, 10, 13, 11, 8, 7, 13
  • 4, 6, 12, 10, 7, 5, 9, 19, 21, 12
  • 4, 6, 12, 11, 5, 5, 11, 18, 21, 13
  • 4, 7, 14, 13, 10, 13, 10, 6, 8, 14
  • 4, 9, 16, 15, 16, 10, 4, 4, 9, 16
  • 5, 6, 12, 10, 5, 5, 11, 18, 21, 13
  • 5, 14, 13, 5, 3, 7, 13, 24, 18, 7
  • 5, 14, 13, 7, 5, 9, 19, 21, 12, 5
  • 6, 7, 15, 16, 15, 10, 6, 5, 7, 15
  • 6, 12, 12, 9, 5, 9, 19, 21, 12, 5
  • 6, 13, 12, 6, 4, 9, 16, 15, 16, 10
  • 6, 13, 12, 10, 8, 13, 12, 10, 13, 11
  • 6, 14, 11, 9, 8, 14, 13, 10, 13, 10
  • 6, 16, 11, 5, 5, 7, 15, 16, 15, 10
  • 6, 16, 11, 5, 5, 11, 18, 21, 13, 4
  • 7, 15, 10, 7, 5, 9, 19, 21, 12, 5
  • 7, 15, 11, 5, 5, 11, 18, 21, 13, 4
  • 7, 16, 11, 6, 8, 14, 13, 10, 13, 10
  • 9, 12, 11, 7, 5, 9, 19, 21, 12, 5
  • 9, 13, 11, 5, 5, 11, 18, 21, 13, 4
  • 9, 13, 12, 8, 7, 13, 12, 10, 13, 11
  • 10, 12, 10, 7, 5, 9, 19, 21, 12, 5
  • 10, 12, 11, 5, 5, 11, 18, 21, 13, 4
  • 10, 14, 10, 6, 8, 14, 13, 10, 13, 10
span 1 {1 1 1}