Structure 7714649

7714648 << 7714649 >> 7714659
Original COD entry Download CIF Download DOT

Citation: Su, Hongkang; Jiao, Jiahao; Wang, Shibin; An, Donghai; Zhang, Min (2024). Rb3MgB5O10 and LiBaAl(BO3)2: covalent tetrahedra MO4-containing borates with deep-ultraviolet cutoff edges.. Dalton transactions (Cambridge, England : 2003), 53, pp. 932-937.

Formula: Al B2 Ba Li O6

Chemical name: LiBaAl(BO3)2

Cell parameters:

  • a = 4.91610(10) Å
  • b = 8.7222(2) Å
  • c = 13.2280(3) Å
  • α = 90°
  • β = 108.2900(10)°
  • γ = 90°

List type: interleaving

List: 2D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 2

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

Dimensionality: 2

Formula: Al2 B4 O12 (Al B2 O6)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 6, 6, 12, 6, 18, 16, 30
  • 2, 5, 4, 9, 6, 15, 12, 25, 12, 27
  • 3, 2, 6, 6, 12, 6, 18, 16, 30, 10
  • 4, 4, 8, 4, 12, 12, 24, 8, 20, 20
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CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: Al2 B4 O12 (Al B2 O6)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 6, 6, 12, 6, 18, 16, 30
  • 2, 5, 4, 9, 6, 15, 12, 25, 12, 27
  • 3, 2, 6, 6, 12, 6, 18, 16, 30, 10
  • 4, 4, 8, 4, 12, 12, 24, 8, 20, 20
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