Structure 4301601

4301598 << 4301601 >> 4301602
Original COD entry Download CIF Download DOT

Citation: Hesham A. Habib; Anke Hoffmann; Henning A. H\"oppe; Gunther Steinfeld; Christoph Janiak (2009). Crystal Structure Solid-State Cross Polarization Magic Angle Spinning 13C NMR Correlation in Luminescent d10 Metal-Organic Frameworks Constructed with the 1,2-Bis(1,2,4-triazol-4-yl)ethane Ligand. Inorganic Chemistry, 48, pp. 2166-2180.

Formula: C8 H8 N8 S2 Zn

Chemical name: catena-{{\m2-1,2-bis(1,2,4-triazol-4-yl)ethane-\kN1:\kN1'}-bis-isothiocyanato-\kN-zinc(II)}

Cell parameters:

  • a = 14.8982(19) Å
  • b = 9.5144(11) Å
  • c = 19.584(2) Å
  • α = 90.00°
  • β = 106.316(2)°
  • 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 4

Basis: (1;1;0)

Dimensionality: 1

Formula: C16 H16 N16 S4 Zn2 (C8 H8 N8 S2 Zn)

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CIF datablock 1, entity 2 of 4

Basis: (1;-1;0)

Dimensionality: 1

Formula: C16 H16 N16 S4 Zn2 (C8 H8 N8 S2 Zn)

span 1 {1 1 1}

CIF datablock 2, entity 3 of 4

Basis: (1;1;0)

Dimensionality: 1

Formula: C16 H16 N16 S4 Zn2 (C8 H8 N8 S2 Zn)

span 1 {1 1 1}

CIF datablock 3, entity 4 of 4

Basis: (1;-1;0)

Dimensionality: 1

Formula: C16 H16 N16 S4 Zn2 (C8 H8 N8 S2 Zn)

span 1 {1 1 1}