Structure 7060752

7060739 << 7060752 >> 7060761
Original COD entry Download CIF Download DOT

Citation: Radha, Govu; Leelasree, T.; Muthukumar, D.; Pillai, Renjith S.; Aggarwal, Himanshu (2021). Highly selective detection of TNP over other nitro compounds in water: the role of selective host--guest interactions in Zr-NDI MOF. New Journal of Chemistry, 45, pp. 12931-12937.

Formula: C17 H7 N O18 Zr3

Cell parameters:

  • a = 21.4898(12) Å
  • b = 25.2933(9) Å
  • c = 33.1199(16) Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

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 2

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: C136 H56 N8 O144 Zr24 (C17 H7 N O18 Zr3)

Multiplicity: 1

span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: C136 H56 N8 O144 Zr24 (C17 H7 N O18 Zr3)

Multiplicity: 1

span 1 {1 1 1}