Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Measurements of binary diffusion coefficients for metal complexes in organic solvents by the Taylor dispersion method

Toriumi, M.[Minoru], Katooka, R.[Ryohei], Funazukuri, T.[Toshitaka], Kong, C. Y.[Chang Yi], Kagei, S.[Seiichiro], Yui, K.[Kazuko]
Fluid Phase Equilib. 2010, 297, 1, 62-66
ABSTRACT
Infinite dilution binary diffusion coefficients, D12, of ferrocene, 1,1-dimethylferrocene and ethylferrocene in hexane, cyclohexane and ethanol at 313.2 K and pressures from 0.2 to 19 MPa, in acetonitrile at 298.2 to 333.2 K and 0.2 MPa, and various metallic acetylacetonate, acac, complexes such as Co(acac)3, Ru(acac)3, Rh(acac)3, Pd(acac)2 and Pt(acac)2 mainly in ethanol at 313.2 K and 0.2 MPa were measured by the Taylor dispersion method. The D12 values in m2 s-1 for the three ferrocenes in the present study and those of ferrocene and 1,1-dimethylferrocene in supercritical carbon dioxide in our previous studies were represented by a modified hydrodynamic equation over a wide range of viscosity, shown in the paper, with average absolute relative deviation of 2.40 % for 316 data points. Although the D12 values for the acac complexes were roughly represented by the hydrodynamic equation shown in the paper, the accuracies were lower because they were dependent on not solute molecular weight but the number of acac ligand in the complex molecules.
Compounds
# Formula Name
1 C15H21CoO6 cobalt tris(acetylacetonate)
2 C10H14O4Pd palladium bis(2,4-pentanedionate)
3 C10H14O4Pt platinum acetylacetonate
4 C15H21O6Rh tris(2,4-pentanedionato-O,O')rhodium
5 C15H21O6Ru ruthenium (III) acetylacetonate
6 C10H10Fe ferrocene
7 C12H14Fe 1,1'-dimethylferrocene
8 C12H14Fe ethyl ferrocene
9 C6H14 hexane
10 C6H12 cyclohexane
11 C2H6O ethanol
Datasets
The table above is generated from the ThermoML associated json file (link above). POMD and RXND refer to PureOrMixture and Reaction Datasets. The compound numbers are included in properties, variables, and phases, if specificied; the numbers refer to the table of compounds on the left.
Type Compound-# Property Variable Constraint Phase Method #Points
  • POMD
  • 6
  • 10
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 6; Liquid
  • Liquid
  • Taylor dispersion method
  • 17
  • POMD
  • 11
  • 6
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 6; Liquid
  • Liquid
  • Taylor dispersion method
  • 3
  • POMD
  • 6
  • 9
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 6; Liquid
  • Liquid
  • Taylor dispersion method
  • 17
  • POMD
  • 10
  • 7
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 7; Liquid
  • Liquid
  • Taylor dispersion method
  • 18
  • POMD
  • 11
  • 7
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 7; Liquid
  • Liquid
  • Taylor dispersion method
  • 3
  • POMD
  • 9
  • 7
  • Binary diffusion coefficient, m2/s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 7; Liquid
  • Liquid
  • Taylor dispersion method
  • 14
  • POMD
  • 10
  • 8
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 8; Liquid
  • Liquid
  • Taylor dispersion method
  • 19
  • POMD
  • 11
  • 8
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 8; Liquid
  • Liquid
  • Taylor dispersion method
  • 3
  • POMD
  • 9
  • 8
  • Binary diffusion coefficient, m2/s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 8; Liquid
  • Liquid
  • Taylor dispersion method
  • 14
  • POMD
  • 10
  • 1
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Taylor dispersion method
  • 1
  • POMD
  • 11
  • 1
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Taylor dispersion method
  • 6
  • POMD
  • 9
  • 1
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Taylor dispersion method
  • 4
  • POMD
  • 11
  • 2
  • Binary diffusion coefficient, m2/s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 2; Liquid
  • Liquid
  • Taylor dispersion method
  • 4
  • POMD
  • 11
  • 3
  • Binary diffusion coefficient, m2/s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 3; Liquid
  • Liquid
  • Taylor dispersion method
  • 4
  • POMD
  • 11
  • 4
  • Binary diffusion coefficient, m2/s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 4; Liquid
  • Liquid
  • Taylor dispersion method
  • 3
  • POMD
  • 11
  • 5
  • Binary diffusion coefficient, m2/s ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 5; Liquid
  • Liquid
  • Taylor dispersion method
  • 4