Structure 7709384

7709373 << 7709384 >> 7709385
Original COD entry Download CIF Download DOT

Citation: H\"ammer, Matthias; Pielnhofer, Florian; Janka, Oliver; Takahashi, Hirotaka; Gross, Peter; P\"ottgen, Rainer; H\"oppe, Henning A (2022). Polymorphism and optical, magnetic and thermal properties of the either phyllo- or inosilicate-analogous borosulfate Cu[B2(SO4)4].. Dalton transactions (Cambridge, England : 2003), 51, pp. 3104-3115.

Formula: B2 Cu O16 S4

Cell parameters:

  • a = 17.662(8) Å
  • b = 5.3362(30) Å
  • c = 14.541(10) Å
  • α = 90.000°
  • β = 125.056(12)°
  • γ = 90.000°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

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

Dimensionality: 3

Formula: B8 Cu4 O64 S16 (B2 Cu O16 S4)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 11, 10, 29, 18, 62, 44, 114
  • 2, 6, 5, 16, 13, 44, 31, 87, 50, 134
  • 2, 6, 5, 17, 13, 42, 31, 87, 50, 135
  • 2, 6, 6, 20, 15, 48, 33, 90, 53, 143
  • 2, 6, 6, 21, 15, 48, 33, 87, 53, 146
  • 2, 8, 7, 20, 15, 44, 31, 90, 49, 138
  • 2, 8, 8, 24, 17, 50, 33, 91, 52, 148
  • 2, 8, 8, 25, 17, 46, 33, 99, 52, 138
  • 4, 3, 11, 10, 29, 18, 62, 44, 114, 55
  • 4, 4, 12, 8, 32, 26, 72, 37, 106, 75
  • 4, 4, 16, 13, 36, 22, 71, 49, 125, 57
  • 6, 6, 18, 12, 36, 28, 76, 36, 116, 74
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