Structure 4332576

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Citation: Sekiya, Ryo; Nishikiori, Shin-ichi; Ogura, Katsuyuki (2006). Coordination Framework Hosts Consisting of 4-Pyridyl-Substituted Carboxylic Acid (PCA) Dimers and 1D Chains of Ni2+and SCN-:  A Rational Structural Extension toward Coordination Framework Hosts with Large Rectangular Cavities. Inorganic Chemistry, 45, pp. 9233-9244.

Formula: C63 H45 N6 Ni1.5 O6 S3

Chemical name: catena-bis(N-trans-4-(2-(4-pyridyl)ethenyl)benzoic acid)nickel(II)-bis(`m-thiocyanato-N,N',S,S')3/2.(benz[a]anthracene)

Cell parameters:

  • a = 10.9741(4) Å
  • b = 16.7648(4) Å
  • c = 33.6402(9) Å
  • α = 120.456(3)°
  • β = 37.4460(10)°
  • γ = 134.530(5)°

List type: noninterleaving

List: 1D

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Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (0;1;0)

Dimensionality: 1

Formula: C102 H78 N12 Ni3 O20 S6 (C102 H78 N12 Ni3 O20 S6)

Multiplicity: 1

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