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Irreversible inhibitors are therefore the equivalent of poisons in heterogeneous catalysis. Safety of 1,1′-Diacetylferrocene, Enzyme inhibitors cause a decrease in the reaction rate of an enzyme-catalyzed reaction by binding to a specific portion of an enzyme and thus slowing or preventing a reaction from occurring. In a patent,Which mentioned a new discovery about 1273-94-5

The heat capacities of acetylferrocene, 1,1?-diacetylferrocene, and 1,1?-diethylferrocene were investigated by low-temperature adiabatic calorimetry in the temperature range from 5 to 300 K and their thermodynamic functions were calculated. The enthalpies of combustion of the substances were determined by calorimetry of combustion, and the thermodynamic functions of their formation were calculated by quantum chemistry methods. Inter- and intramolecular interactions of the ferrocene derivatives were also studied by the methods of molecular mechanics and molecular dynamics.

Thermodynamics and molecular dynamics of some ferrocene derivatives

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Reference:
Iron Catalysis in Organic Synthesis | Chemical Reviews,
Iron Catalysis in Organic Synthesis: A Critical Assessment of What It Takes To Make This Base Metal a Multitasking Champion