Structure 4103070

4103059 << 4103070 >> 4103141
Original COD entry Download CIF Download DOT

Citation: Yi-Zhi Huang; Li-Ming Wu; Xin-Tao Wu; Long-Hua Li; Ling Chen; Yong-Fan Zhang (2010). Pb2B5O9I: An Iodide Borate with Strong Second Harmonic Generation. Journal of the American Chemical Society, 132, pp. 12788-12789.

Formula: B5 I O9 Pb2

Chemical name: ?

Cell parameters:

  • a = 11.561(4) Å
  • b = 11.700(4) Å
  • c = 6.524(2) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

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: B20 I4 O36 Pb8 (B5 I O9 Pb2)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 10, 18, 18, 38, 36, 72, 86, 152
  • 2, 5, 5, 11, 16, 30, 31, 60, 60, 106
  • 2, 5, 6, 11, 12, 27, 35, 62, 62, 108
  • 2, 5, 6, 12, 15, 30, 36, 67, 68, 124
  • 2, 5, 6, 13, 16, 29, 30, 62, 71, 121
  • 2, 5, 7, 15, 18, 33, 35, 71, 75, 131
  • 2, 6, 8, 14, 17, 36, 37, 70, 76, 127
  • 3, 3, 8, 10, 19, 22, 41, 46, 86, 82
  • 3, 4, 10, 12, 23, 28, 52, 56, 107, 101
  • 3, 6, 11, 14, 28, 28, 57, 63, 117, 112
  • 3, 6, 13, 12, 24, 30, 59, 63, 111, 97
  • 3, 7, 8, 15, 16, 34, 43, 80, 77, 130
  • 3, 7, 8, 15, 17, 37, 43, 78, 75, 131
  • 3, 7, 8, 15, 19, 39, 42, 78, 81, 141
  • 4, 5, 10, 12, 24, 27, 53, 61, 107, 97
  • 4, 5, 10, 13, 26, 28, 55, 57, 101, 106
  • 4, 6, 10, 9, 22, 31, 57, 60, 105, 85
  • 4, 8, 10, 20, 22, 44, 48, 92, 92, 156
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