DynamicsDynamics/Enthalpies of Activation/Entropies of Activation/Free Energies of Activation/Rate Constants
Product Distributions/Stereochemistry
Thermodynamic/Thermochemical/Equilibrium Constants/Heats of Reaction/Ionization Potentials/Redox Potentials/Standard Enthalpies of Reaction/Standard Entropies of Reaction/Standard Free Energies of Reaction
Spectroscopic Properties/IR CO Stretching Frequencies/IR NO Stretching Frequencies/IR CN Stretching Frequencies/IR M-H Stretching Frequencies/NMR Chemical Shifts -Carbon/NMR Chemical Shifts -Hydrogen/NMR Chemical Shifts-Phosphorus/ NMR Chemical Shifts- Ligating atom (other)/NMR Chemical Shifts-Metal/NMR CouplingConstants H-C/NMR CouplingConstants H-P/NMR CouplingConstants C-P/NMR Coupling Constants C-Pt/NMR Coupling Constants P-Pt
Structural Properties/Bond Angles/Bond Lengths
Dynamics
Property: log k for the following second order reaction
h-(C5H5)Fe(CO)(acetone)(COMe)+ +SZ2 = h-(C5H5)Fe(CO)(SZ2)(COMe)+ + acetone (Analysis)
Property: log k for the following second order reaction
h-(C5Me5)Fe(CO)(acetone)(COMe)+ +SZ2 = h-(C5Me5)Fe(CO)(SZ2)(COMe)+ + acetone (Analysis)
Product Distributions
Thermodynamic/Thermochemical
h-(C5H5)Fe(CO)(SZ2)(COMe)+ + e = h-(C5H5)Fe(CO)(SZ2)(COMe) (Analysis)
Standard Enthalpies of Reaction
Standard Entropies of Reaction
Standard Free Energies of Reaction
Spectroscopic Properties
NMR Chemical Shifts-Phosphorus
NMR Chemical Shifts- Ligating atom (other)
Structural Properties