Structure 4510302

4510301 << 4510302 >> 4510303
Original COD entry Download CIF Download DOT

Citation: Han, Shujuan; Wang, Ying; Pan, Shilie; Dong, Xiaoyu; Wu, Hongping; Han, Jian; Yang, Yun; Yu, Hongwei; Bai, Chunyan (2014). Noncentrosymmetric versus Centrosymmetric: Influence of the Na+Substitution on Structural Transition and Second-Harmonic Generation Property. Crystal Growth & Design, 14, pp. 1794-.

Formula: B6 Br K2.87 Na0.13 O10

Chemical name: ?

Cell parameters:

  • a = 10.071(3) Å
  • b = 10.071(3) Å
  • c = 8.824(4) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 120.00°

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: B18 O30 (B3 O5)

Multiplicity: 1

Coordination sequences:

  • 2, 5, 5, 11, 10, 21, 19, 41, 37, 71
  • 2, 5, 6, 13, 10, 20, 20, 47, 40, 74
  • 3, 3, 8, 9, 17, 12, 29, 33, 64, 44
  • 3, 9, 6, 9, 9, 24, 27, 51, 33, 66
  • 4, 5, 10, 7, 16, 18, 38, 31, 61, 44
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