Structure 7709387

7709386 << 7709387 >> 7709388
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

Chemical name: alpha-Copper(II) Borosulfate

Cell parameters:

  • a = 5.26356(15) Å
  • b = 7.1449(2) Å
  • c = 7.9352(2) Å
  • α = 73.6982(16)°
  • β = 70.7367(18)°
  • γ = 86.677(2)°

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: B2 Cu O16 S4 (B2 Cu O16 S4)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 3, 11, 9, 25, 17, 61, 45, 119
  • 2, 6, 5, 15, 11, 38, 30, 88, 52, 136
  • 2, 6, 5, 16, 11, 38, 30, 88, 52, 135
  • 2, 6, 6, 20, 14, 45, 31, 85, 54, 144
  • 2, 6, 6, 21, 14, 44, 31, 84, 54, 147
  • 2, 8, 7, 20, 14, 41, 31, 91, 48, 133
  • 2, 8, 8, 24, 17, 48, 32, 92, 50, 137
  • 2, 8, 8, 25, 17, 48, 32, 92, 50, 138
  • 4, 3, 11, 9, 25, 17, 61, 45, 119, 55
  • 4, 4, 12, 7, 28, 24, 68, 37, 107, 74
  • 4, 4, 16, 13, 36, 21, 67, 48, 125, 55
  • 6, 6, 18, 12, 36, 28, 76, 34, 108, 72
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