Structure 4517316

4517315 << 4517316 >> 4517317
Original COD entry Download CIF Download DOT

Citation: Wang, Zujian; He, Jiangang; Hu, Bing; Shan, Pai; Xiong, Zheyao; Su, Rongbing; He, Chao; Yang, Xiaoming; Long, Xifa (2020). Ca2B5O9Cl and Sr2B5O9Cl: Nonlinear Optical Crystals with Deep-Ultraviolet Transparency Windows.. ACS applied materials & interfaces, 12, pp. 4632-4637.

Formula: B10 Ca4 Cl2 O18

Cell parameters:

  • a = 11.1369(6) Å
  • b = 11.2626(5) Å
  • c = 6.2995(3) 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 O36 (B5 O9)

Multiplicity: 1

Coordination sequences:

  • 2, 5, 4, 9, 8, 20, 19, 42, 33, 69
  • 2, 5, 4, 10, 10, 22, 18, 41, 33, 72
  • 2, 5, 5, 12, 10, 22, 19, 45, 37, 79
  • 2, 6, 5, 10, 9, 22, 20, 46, 35, 70
  • 2, 6, 6, 12, 10, 24, 20, 48, 38, 73
  • 3, 3, 8, 7, 16, 14, 32, 27, 61, 46
  • 4, 4, 8, 6, 16, 16, 36, 30, 62, 37
  • 4, 4, 9, 8, 18, 15, 36, 31, 65, 45
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