Structure 1570516

1570487 << 1570516 >> 1570517
Original COD entry Download CIF Download DOT

Citation: Lei, Guorong; Cheng, Wenchuan; Lu, Zujia; Zhang, Tonglai; Li, Zhimin; Zhang, Jianguo (2023). A three-dimensional energetic coordination compound (BLG-1) with excellent initiating ability for lead-free primary explosives.. Materials horizons, 10, pp. 5775-5781.

Formula: C4 H4 Br2 Cu N8 O6

Cell parameters:

  • a = 9.3556(9) Å
  • b = 6.8168(7) Å
  • c = 9.3773(8) Å
  • α = 90.00°
  • β = 93.497(2)°
  • γ = 90.00°

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: C8 H8 Br4 Cu2 N16 O12 (C4 H4 Br2 Cu N8 O6)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 2, 10, 14, 24, 14, 34, 44, 74
  • 1, 2, 3, 3, 6, 8, 15, 7, 26, 35
  • 1, 2, 4, 7, 7, 13, 10, 22, 34, 56
  • 2, 3, 6, 5, 6, 11, 17, 17, 27, 50
  • 2, 4, 7, 7, 12, 8, 25, 30, 55, 34
  • 2, 7, 8, 17, 14, 29, 30, 55, 46, 67
  • 3, 2, 10, 14, 24, 14, 34, 44, 74, 50
  • 3, 3, 3, 6, 8, 15, 7, 26, 35, 61
  • 3, 4, 7, 7, 13, 10, 22, 34, 56, 39
  • 3, 5, 2, 7, 10, 12, 11, 27, 40, 56
  • 3, 8, 8, 12, 7, 23, 33, 51, 33, 51
  • 6, 8, 14, 8, 22, 30, 52, 32, 46, 70
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