Structure 1560698

1560697 << 1560698 >> 1560699
Original COD entry Download CIF Download DOT

Citation: Chen, Xuean; Yue, Jianying; Chang, Xinan; Xiao, Weiqiang (2017). Synthesis and characterization of a new borate Ba 6 Al 4 B 14 O 33 with building blocks of AlO 4 , Al 4 O 14 , BO 3 , B 6 O 14 , and B 6 O 13. Journal of Solid State Chemistry, 245, pp. 174-183.

Formula: Al4 B14 Ba6 O33

Cell parameters:

  • a = 7.0070(14) Å
  • b = 13.880(3) Å
  • c = 14.702(3) Å
  • α = 86.48(3)°
  • β = 88.99(3)°
  • γ = 83.46(3)°

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: Al8 B28 O66 (Al4 B14 O33)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 6, 6, 14, 11, 23, 17, 42
  • 1, 2, 2, 6, 6, 14, 11, 28, 24, 44
  • 1, 2, 2, 6, 7, 18, 17, 31, 27, 51
  • 1, 2, 2, 9, 11, 19, 23, 34, 39, 47
  • 2, 4, 3, 8, 10, 26, 24, 44, 40, 69
  • 2, 5, 4, 8, 7, 18, 17, 42, 33, 62
  • 2, 5, 4, 8, 8, 22, 21, 43, 36, 63
  • 2, 5, 4, 8, 8, 22, 22, 45, 38, 64
  • 2, 5, 4, 10, 9, 18, 13, 34, 29, 55
  • 2, 5, 4, 10, 9, 19, 13, 33, 27, 53
  • 2, 5, 4, 10, 9, 20, 15, 31, 26, 59
  • 2, 5, 4, 10, 9, 20, 16, 39, 38, 57
  • 2, 5, 4, 10, 9, 21, 15, 32, 30, 52
  • 2, 5, 4, 10, 9, 23, 19, 33, 33, 57
  • 2, 5, 4, 10, 10, 24, 19, 35, 30, 61
  • 2, 5, 4, 10, 11, 26, 26, 42, 44, 57
  • 2, 5, 4, 13, 14, 25, 24, 36, 41, 55
  • 2, 5, 4, 13, 16, 29, 33, 46, 57, 67
  • 2, 5, 5, 12, 9, 20, 15, 34, 30, 65
  • 2, 5, 5, 12, 9, 23, 18, 36, 33, 53
  • 2, 5, 5, 14, 15, 27, 24, 47, 42, 64
  • 2, 5, 6, 15, 14, 27, 25, 48, 43, 70
  • 2, 5, 6, 15, 14, 27, 26, 49, 43, 69
  • 2, 6, 5, 9, 7, 18, 16, 39, 32, 58
  • 2, 6, 5, 11, 11, 26, 26, 42, 47, 69
  • 2, 6, 6, 12, 8, 20, 18, 38, 34, 61
  • 2, 6, 6, 12, 8, 22, 19, 34, 32, 53
  • 2, 6, 7, 17, 22, 33, 38, 48, 57, 65
  • 2, 7, 8, 14, 16, 30, 34, 49, 50, 62
  • 2, 8, 9, 15, 21, 31, 38, 45, 52, 61
  • 2, 8, 10, 18, 24, 34, 44, 53, 59, 68
  • 3, 2, 6, 6, 14, 11, 23, 17, 42, 37
  • 3, 2, 6, 6, 14, 11, 28, 24, 44, 46
  • 3, 2, 6, 7, 18, 17, 31, 27, 51, 45
  • 3, 2, 9, 11, 19, 23, 34, 39, 47, 55
  • 3, 3, 7, 7, 18, 18, 37, 33, 58, 52
  • 3, 3, 7, 7, 18, 18, 38, 35, 60, 50
  • 3, 3, 8, 7, 15, 11, 27, 21, 49, 44
  • 3, 3, 8, 7, 17, 14, 31, 28, 44, 47
  • 3, 3, 12, 15, 25, 31, 42, 53, 63, 65
  • 3, 10, 10, 20, 19, 40, 36, 57, 47, 69
  • 3, 10, 11, 19, 20, 39, 35, 47, 54, 66
  • 4, 4, 7, 5, 14, 15, 37, 30, 56, 45
  • 4, 4, 9, 7, 15, 11, 29, 25, 48, 41
  • 4, 4, 9, 7, 17, 13, 28, 24, 49, 43
  • 4, 4, 9, 7, 17, 14, 31, 30, 53, 55
  • 4, 4, 9, 7, 20, 17, 28, 28, 47, 49
  • 4, 4, 9, 9, 23, 25, 39, 44, 60, 60
  • 4, 5, 13, 13, 24, 23, 43, 39, 60, 61
  • 5, 7, 13, 15, 28, 32, 43, 47, 58, 67
  • 7, 9, 14, 19, 28, 38, 45, 51, 58, 66
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