Structure 1514408

1514395 << 1514408 >> 1514409
Original COD entry Download CIF Download DOT

Citation: Dau, Phuong V.; Kim, Min; Cohen, Seth M. (2013). Site-selective cyclometalation of a metal--organic framework. Chemical Science, 4, pp. 601-.

Formula: C34 H18 Ir0.11 N4 O8 Zn2

Cell parameters:

  • a = 14.0368(15) Å
  • b = 15.1189(17) Å
  • c = 15.1242(17) Å
  • α = 85.358(6)°
  • β = 85.555(5)°
  • γ = 86.350(6)°

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: C34 H18 Ir2 N6 O8 Zn2 (C17 H9 Ir N3 O4 Zn)

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: C34 H18 Ir2 N6 O8 Zn2 (C17 H9 Ir N3 O4 Zn)

Multiplicity: 1

span 1 {1 1 1}