Structure 7219499

7219481 << 7219499 >> 7219505
Original COD entry Download CIF Download DOT

Citation: Bai, Shizhe; Zhang, Weiquan; Ling, Yun; Yang, Feilong; Deng, Mingli; Chen, Zhenxia; Weng, Linhong; Zhou, Yaming (2015). Predicting and creating 7-connected Zn4O vertices for the construction of an exceptional metal--organic framework with nanoscale cages. CrystEngComm, 17, pp. 1923-.

Formula: C58 H45.33 N2 O36.17 Zn8

Chemical name: ?

Cell parameters:

  • a = 52.623(3) Å
  • b = 52.623(3) Å
  • c = 52.623(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: C2688 H1008 O1536 Zn384 (C56 H21 O32 Zn8)

Coordination sequences:

  • 1, 2, 4, 7, 5, 16, 30, 15, 25, 44
  • 1, 2, 4, 7, 5, 18, 28, 15, 26, 44
  • 1, 2, 4, 7, 5, 19, 29, 15, 27, 48
  • 1, 2, 4, 7, 5, 20, 26, 15, 26, 44
  • 1, 2, 4, 7, 5, 20, 30, 15, 26, 44
  • 1, 2, 4, 7, 5, 24, 26, 15, 26, 44
  • 1, 2, 4, 7, 7, 12, 19, 17, 38, 52
  • 1, 2, 4, 7, 7, 12, 21, 17, 36, 52
  • 1, 2, 4, 7, 7, 13, 19, 18, 40, 52
  • 1, 2, 4, 7, 7, 13, 19, 19, 40, 52
  • 1, 2, 4, 7, 7, 13, 19, 19, 42, 54
  • 1, 2, 4, 7, 7, 14, 18, 19, 44, 49
  • 1, 2, 4, 7, 7, 14, 20, 18, 39, 52
  • 1, 2, 4, 7, 7, 14, 20, 18, 41, 54
  • 1, 2, 4, 7, 7, 14, 20, 19, 41, 52
  • 1, 2, 4, 7, 7, 16, 18, 21, 40, 49
  • 1, 7, 13, 10, 11, 22, 24, 29, 39, 62
  • 1, 8, 15, 7, 11, 22, 24, 29, 37, 52
  • 2, 7, 11, 14, 11, 21, 28, 32, 51, 51
  • 2, 7, 11, 14, 11, 21, 28, 34, 50, 50
  • 2, 7, 12, 13, 11, 21, 28, 33, 46, 52
  • 2, 7, 12, 15, 11, 21, 28, 32, 49, 51
  • 2, 7, 12, 15, 11, 21, 28, 34, 47, 51
  • 2, 7, 13, 14, 11, 21, 28, 33, 49, 51
  • 2, 8, 12, 13, 12, 23, 27, 35, 45, 50
  • 2, 8, 12, 13, 12, 23, 27, 36, 45, 49
  • 2, 8, 12, 13, 12, 23, 27, 36, 50, 49
  • 2, 8, 13, 12, 12, 23, 27, 34, 46, 51
  • 2, 8, 14, 10, 11, 21, 28, 32, 51, 49
  • 2, 8, 14, 10, 11, 21, 28, 33, 46, 49
  • 2, 8, 14, 10, 11, 21, 28, 34, 50, 47
  • 2, 8, 16, 10, 11, 21, 28, 32, 49, 49
  • 2, 8, 16, 10, 11, 21, 28, 33, 49, 48
  • 2, 8, 16, 10, 11, 21, 28, 34, 47, 48
  • 2, 9, 13, 13, 12, 23, 27, 35, 50, 58
  • 2, 9, 13, 13, 12, 23, 27, 38, 46, 55
  • 2, 9, 14, 10, 12, 23, 27, 34, 46, 50
  • 2, 9, 14, 10, 12, 23, 27, 35, 45, 50
  • 2, 9, 14, 10, 12, 23, 27, 36, 45, 49
  • 2, 9, 14, 10, 12, 23, 27, 36, 50, 50
  • 2, 9, 14, 12, 12, 23, 27, 35, 50, 59
  • 2, 10, 15, 10, 12, 23, 27, 35, 46, 46
  • 2, 10, 15, 10, 12, 23, 27, 35, 46, 47
  • 2, 10, 15, 10, 12, 23, 27, 37, 44, 46
  • 3, 4, 7, 5, 16, 30, 15, 25, 44, 50
  • 3, 4, 7, 5, 18, 28, 15, 26, 44, 50
  • 3, 4, 7, 5, 19, 29, 15, 27, 48, 52
  • 3, 4, 7, 5, 19, 29, 15, 27, 48, 54
  • 3, 4, 7, 5, 20, 26, 15, 26, 44, 55
  • 3, 4, 7, 5, 20, 30, 15, 26, 44, 50
  • 3, 4, 7, 5, 24, 26, 15, 26, 44, 51
  • 3, 4, 7, 7, 12, 19, 17, 38, 52, 42
  • 3, 4, 7, 7, 12, 21, 17, 36, 52, 42
  • 3, 4, 7, 7, 13, 19, 18, 40, 52, 37
  • 3, 4, 7, 7, 13, 19, 18, 40, 52, 39
  • 3, 4, 7, 7, 13, 19, 19, 40, 52, 42
  • 3, 4, 7, 7, 13, 19, 19, 42, 54, 40
  • 3, 4, 7, 7, 14, 18, 19, 44, 49, 37
  • 3, 4, 7, 7, 14, 20, 18, 39, 52, 40
  • 3, 4, 7, 7, 14, 20, 18, 41, 54, 42
  • 3, 4, 7, 7, 14, 20, 19, 41, 52, 37
  • 3, 4, 7, 7, 14, 20, 19, 41, 52, 39
  • 3, 4, 7, 7, 16, 18, 21, 40, 49, 37
  • 3, 4, 11, 15, 11, 16, 30, 39, 36, 54
  • 3, 4, 11, 17, 11, 16, 30, 37, 36, 54
  • 3, 4, 12, 15, 11, 17, 33, 35, 35, 56
  • 3, 4, 12, 15, 11, 17, 33, 35, 35, 59
  • 3, 4, 12, 15, 11, 17, 34, 37, 38, 57
  • 3, 4, 12, 15, 11, 17, 34, 37, 38, 58
  • 3, 4, 13, 14, 11, 17, 34, 34, 35, 60
  • 3, 4, 13, 16, 11, 17, 33, 36, 38, 56
  • 3, 4, 13, 16, 11, 17, 33, 36, 38, 61
  • 3, 4, 13, 16, 11, 17, 34, 36, 35, 55
  • 3, 4, 13, 16, 11, 17, 34, 36, 35, 58
  • 3, 4, 15, 14, 11, 17, 36, 34, 35, 56
  • 3, 6, 5, 12, 18, 16, 29, 30, 44, 68
  • 3, 6, 5, 12, 20, 16, 27, 30, 44, 68
  • 3, 6, 5, 13, 18, 17, 28, 31, 44, 66
  • 3, 6, 5, 13, 18, 17, 28, 31, 44, 69
  • 3, 6, 5, 13, 18, 18, 29, 32, 46, 72
  • 3, 6, 5, 13, 18, 18, 29, 32, 48, 71
  • 3, 6, 5, 14, 17, 18, 27, 31, 49, 63
  • 3, 6, 5, 14, 19, 17, 28, 32, 46, 69
  • 3, 6, 5, 14, 19, 17, 28, 32, 48, 74
  • 3, 6, 5, 14, 19, 18, 29, 31, 44, 66
  • 3, 6, 5, 14, 19, 18, 29, 31, 44, 69
  • 3, 6, 5, 16, 17, 20, 27, 31, 45, 63
  • 3, 6, 7, 8, 9, 18, 40, 38, 32, 60
  • 3, 6, 7, 8, 9, 20, 41, 37, 33, 60
  • 3, 6, 7, 8, 9, 21, 41, 36, 34, 63
  • 3, 6, 7, 8, 9, 21, 43, 38, 34, 63
  • 3, 6, 7, 8, 9, 22, 43, 37, 33, 60
  • 3, 6, 7, 8, 9, 22, 44, 34, 33, 57
  • 3, 6, 7, 8, 9, 26, 40, 34, 33, 57
  • 4, 14, 7, 7, 14, 28, 21, 35, 40, 64
  • 4, 16, 7, 7, 14, 28, 21, 35, 40, 66
  • 6, 11, 11, 10, 20, 25, 27, 38, 53, 79
  • 6, 12, 12, 10, 20, 25, 27, 38, 53, 78
  • 7, 12, 10, 11, 22, 24, 29, 38, 54, 70
  • 7, 14, 7, 10, 20, 25, 27, 38, 53, 75
  • 7, 16, 7, 10, 20, 25, 27, 38, 53, 74
  • 8, 13, 10, 11, 22, 24, 29, 39, 62, 71
  • 8, 14, 7, 11, 22, 24, 29, 38, 54, 70
  • 9, 15, 7, 11, 22, 24, 29, 37, 52, 65
span 1 {1 1 1}