Structure 1534247

1534245 << 1534247 >> 1534248
Original COD entry Download CIF Download DOT

Citation: Belokoneva, E.L.; Dimitrova, O.V.; Kabalov, Yu.K.; Stefanovich, S.Yu. (2003). New hilgardite-group polyborate Pb2 [B5 O9] Br with a high optical nonlinearity. Kristallografiya, 48, pp. 49-53.

Formula: B5 Br O9 Pb2

Chemical name: Pb2 (B5 O9) Br

Cell parameters:

  • a = 11.524 Å
  • b = 11.431 Å
  • c = 6.5399 Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
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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 Br4 O36 Pb8 (B5 Br O9 Pb2)

Multiplicity: 1

Coordination sequences:

  • 2, 2, 6, 6, 10, 22, 22, 42, 38, 80
  • 2, 4, 4, 8, 14, 16, 32, 30, 62, 58
  • 2, 5, 4, 9, 10, 22, 26, 48, 43, 77
  • 2, 5, 4, 10, 13, 24, 24, 47, 42, 81
  • 2, 5, 5, 10, 11, 23, 26, 47, 48, 83
  • 2, 5, 6, 13, 13, 24, 24, 50, 57, 96
  • 2, 5, 6, 13, 14, 25, 25, 51, 53, 92
  • 2, 5, 8, 8, 17, 18, 31, 33, 71, 71
  • 2, 6, 5, 10, 12, 25, 29, 54, 44, 77
  • 2, 6, 6, 11, 12, 25, 27, 52, 53, 88
  • 2, 6, 7, 13, 14, 28, 27, 54, 55, 88
  • 3, 3, 8, 8, 17, 19, 36, 36, 70, 66
  • 3, 4, 9, 10, 19, 18, 35, 40, 73, 71
  • 3, 6, 7, 13, 14, 27, 26, 50, 59, 106
  • 4, 4, 6, 12, 14, 24, 24, 52, 52, 100
  • 4, 4, 8, 7, 17, 22, 41, 39, 70, 58
  • 4, 4, 9, 10, 20, 22, 42, 39, 73, 68
  • 4, 5, 10, 11, 21, 19, 40, 47, 80, 75
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