Structure 7712351

7712350 << 7712351 >> 7712393
Original COD entry Download CIF Download DOT

Citation: Liu, Wenhao; Lee, Ming-Hsien; Guo, Ruixin; Yao, Jiyong (2023). Two non-centrosymmetric mixed alkali metal and alkaline earth metal scandium borate nonlinear optical materials with short ultraviolet cutoff edges. Dalton Transactions, , pp. -.

Formula: B15 Ca O30 Rb7 Sc2

Cell parameters:

  • a = 13.3114(10) Å
  • b = 13.3114(10) Å
  • c = 14.5992(16) Å
  • α = 90°
  • β = 90°
  • γ = 120°

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: B45 O90 Sc6 (B15 O30 Sc2)

Multiplicity: 1

Coordination sequences:

  • 2, 4, 3, 12, 12, 23, 22, 50, 36, 88
  • 2, 5, 4, 9, 8, 25, 25, 47, 35, 78
  • 2, 5, 4, 9, 8, 25, 25, 49, 39, 82
  • 2, 7, 7, 14, 13, 28, 22, 57, 47, 106
  • 2, 7, 7, 14, 13, 28, 22, 59, 49, 106
  • 3, 3, 9, 8, 18, 17, 40, 32, 70, 56
  • 3, 3, 9, 8, 18, 17, 40, 34, 74, 54
  • 4, 4, 6, 4, 20, 20, 40, 36, 64, 44
  • 6, 6, 12, 12, 24, 18, 48, 37, 90, 90
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