Structure 7005278

7005277 << 7005278 >> 7005283
Original COD entry Download CIF Download DOT

Citation: Rodr\'iguez-Di\'eguez, A; Salinas-Castillo, A; Galli, S.; Masciocchi, N.; M Guti\'errez-Zorrilla, J; Vitoria, P.; Colacio, E. (2007). Synthesis, X-ray structures and luminescence properties of three multidimensional metal-organic frameworks incorporating the versatile 5-(pyrimidyl)tetrazolato bridging ligand.. Dalton transactions (Cambridge, England : 2003), , pp. 1821-1828.

Formula: C5 H5 Cd Cl0.5 N7.5 O

Chemical name: catena-(mu-chloro)-(mu-N,N'-azide)-bis(mu4-5-(pyrimidil)tetrazolate-aquo)--cadmium(ii)

Cell parameters:

  • a = 16.10858(80) Å
  • b = 6.60053(31) Å
  • c = 17.24252(89) Å
  • α = 90°
  • β = 95.1767(44)°
  • γ = 90°

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: C20 H12 Cd4 Cl2 N30 O4 (C10 H6 Cd2 Cl N15 O2)

Multiplicity: 1

Coordination sequences:

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

CIF datablock 1, entity 2 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: C20 H12 Cd4 Cl2 N30 O4 (C10 H6 Cd2 Cl N15 O2)

Multiplicity: 1

span 1 {1 1 1}