Structure 4306948

4306930 << 4306948 >> 4306978
Original COD entry Download CIF Download DOT

Citation: Lin Cheng; Wei-Xiong Zhang; Bao-Hui Ye; Jian-Bin Lin; Xiao-Ming Chen (2007). In Situ Solvothermal Generation of 1,2,4-Triazolates and Related Compounds from Organonitrile and Hydrazine Hydrate: A Mechanism Study. Inorganic Chemistry, 46, pp. 1135-1143.

Formula: C12 H8 Cu N5

Chemical name: ?

Cell parameters:

  • a = 11.4967(10) Å
  • b = 11.4967(10) Å
  • c = 18.224(4) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 90.00°

List type: interleaving

List: 1D

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 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C48 H32 Cu4 N20 (C12 H8 Cu N5)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C48 H32 Cu4 N20 (C12 H8 Cu N5)

Multiplicity: 1

Coordination sequences:

  • 1, 2, 4, 3, 3, 4, 6, 9, 12, 14
  • 1, 2, 4, 3, 3, 5, 8, 12, 15, 13
  • 1, 2, 4, 3, 4, 6, 7, 8, 10, 14
  • 1, 2, 4, 3, 4, 6, 8, 10, 12, 16
  • 1, 2, 4, 5, 5, 6, 9, 12, 14, 14
  • 1, 2, 4, 5, 6, 8, 12, 15, 13, 12
  • 1, 2, 4, 6, 7, 7, 8, 10, 14, 15
  • 1, 2, 4, 6, 7, 8, 10, 12, 16, 14
  • 2, 4, 7, 11, 17, 14, 11, 12, 14, 14
  • 3, 4, 3, 3, 4, 6, 9, 12, 14, 14
  • 3, 4, 3, 3, 5, 8, 12, 15, 13, 12
  • 3, 4, 3, 4, 6, 7, 8, 10, 14, 15
  • 3, 4, 3, 4, 6, 8, 10, 12, 16, 14
  • 3, 4, 5, 5, 6, 9, 12, 14, 14, 14
  • 3, 4, 5, 6, 8, 12, 15, 13, 12, 14
  • 3, 4, 6, 7, 7, 8, 10, 14, 15, 12
  • 3, 4, 6, 7, 8, 10, 12, 16, 14, 11
  • 3, 5, 7, 11, 13, 14, 12, 13, 15, 13
  • 3, 6, 7, 7, 9, 12, 14, 14, 14, 13
  • 3, 6, 8, 9, 12, 15, 13, 12, 14, 14
  • 3, 6, 8, 14, 15, 14, 13, 12, 13, 14
  • 3, 6, 9, 13, 16, 13, 11, 14, 15, 12
  • 3, 7, 9, 8, 8, 10, 14, 15, 12, 11
  • 3, 7, 9, 9, 10, 12, 16, 14, 11, 13
  • 3, 7, 9, 14, 14, 12, 13, 14, 13, 12
  • 4, 8, 11, 11, 11, 14, 15, 12, 11, 14
span 1 {1 1 1}