Structure 4123937

4123936 << 4123937 >> 4123938
Original COD entry Download CIF Download DOT

Citation: Long, J.R.; McCarty, L.S.; Holm, R.H. (1996). A solid-state route to molecular clusters: access to the solution chemistry of (Re6 Q8)(2+) (Q = S, Se) core-containing clusters via dimensional reduction. Journal of the American Chemical Society, 118, pp. 4603-4616.

Formula: Cs I3 Re6 Se8

Chemical name: Cs ((Re I)3 Re3 Se8)

Cell parameters:

  • a = 6.565 Å
  • b = 19.678 Å
  • c = 15.793 Å
  • α = 90°
  • β = 96.77°
  • γ = 90°

List type: interleaving

List: 2D

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span 1 {1 1 1}
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Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 2

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

Dimensionality: 2

Formula: I6 Re12 Se16 (I3 Re6 Se8)

Multiplicity: 1

Coordination sequences:

  • 1, 8, 10, 13, 36, 29, 40, 54, 46, 75
  • 2, 16, 20, 22, 40, 30, 56, 70, 46, 62
  • 3, 12, 9, 27, 32, 30, 53, 49, 54, 83
  • 3, 12, 9, 27, 32, 34, 53, 45, 54, 83
  • 4, 19, 14, 16, 51, 46, 30, 60, 71, 69
  • 9, 10, 13, 36, 29, 40, 54, 46, 75, 72
  • 9, 11, 19, 31, 26, 47, 51, 51, 65, 74
  • 9, 12, 15, 28, 40, 40, 47, 48, 72, 79
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: I6 Re12 Se16 (I3 Re6 Se8)

Multiplicity: 1

Coordination sequences:

  • 1, 8, 10, 13, 36, 29, 40, 54, 46, 75
  • 2, 16, 20, 22, 40, 30, 56, 70, 46, 62
  • 3, 12, 9, 27, 32, 30, 53, 49, 54, 83
  • 3, 12, 9, 27, 32, 34, 53, 45, 54, 83
  • 4, 19, 14, 16, 51, 46, 30, 60, 71, 69
  • 9, 10, 13, 36, 29, 40, 54, 46, 75, 72
  • 9, 11, 19, 31, 26, 47, 51, 51, 65, 74
  • 9, 12, 15, 28, 40, 40, 47, 48, 72, 79
span 1 {1 1 1}