Structure 4110732

4110715 << 4110732 >> 4110769
Original COD entry Download CIF Download DOT

Citation: J. N. Behera; C. N. R. Rao (2006). A Ni2+ (S = 1) Kagome Compound Templated by 1,8-Diazacubane. Journal of the American Chemical Society, 128, pp. 9334-9335.

Formula: C6 H16 F6 N4 Ni3 O8 S2

Chemical name: ?

Cell parameters:

  • a = 7.3166(3) Å
  • b = 7.3166(3) Å
  • c = 26.1924(13) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 120.00°

List type: interleaving

List: 2D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 3

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: F6 Ni3 O8 S2 (F6 Ni3 O8 S2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 12, 9, 30, 18, 57, 24, 72
  • 2, 8, 5, 17, 12, 40, 22, 66, 28, 86
  • 2, 10, 8, 25, 15, 49, 24, 71, 31, 95
  • 4, 3, 12, 9, 30, 18, 57, 24, 72, 33
  • 6, 6, 20, 12, 40, 22, 66, 28, 86, 36
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CIF datablock 1, entity 2 of 3

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: F6 Ni3 O8 S2 (F6 Ni3 O8 S2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 12, 9, 30, 18, 57, 24, 72
  • 2, 8, 5, 17, 12, 40, 22, 66, 28, 86
  • 2, 10, 8, 25, 15, 49, 24, 71, 31, 95
  • 4, 3, 12, 9, 30, 18, 57, 24, 72, 33
  • 6, 6, 20, 12, 40, 22, 66, 28, 86, 36
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CIF datablock 2, entity 3 of 3

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: F6 Ni3 O8 S2 (F6 Ni3 O8 S2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 12, 9, 30, 18, 57, 24, 72
  • 2, 8, 5, 17, 12, 40, 22, 66, 28, 86
  • 2, 10, 8, 25, 15, 49, 24, 71, 31, 95
  • 4, 3, 12, 9, 30, 18, 57, 24, 72, 33
  • 6, 6, 20, 12, 40, 22, 66, 28, 86, 36
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