Product Details of 1273-94-5, Healthcare careers for chemists are once again largely based in laboratories, although increasingly there is opportunity to work at the point of care, helping with patient investigation. 1273-94-5, Name is 1,1′-Diacetylferrocene, molecular weight is 262.0412. molecular formula is C14H6FeO2. In an Article，once mentioned of 1273-94-5
The effect of substituents in the Cp ligands on the electronic structure has been studied for the 1,1′-disubstituted ferrocenes Fe(CpX)2, with X = C2H5, OCH3, CN, COCH3, COOCH3, OOCCH3, CH2C6H5, or C6H5, by UV photoelectron spectroscopy and by CNDO/2 calculations.The energy gap between the 2E2g and 2A1g ion states, 0.36 eV in the parent ferrocene, is affected only by the COCH3 and COOCH3 substituents, which lower it to 0.22 and 0.28 eV, respectively.Splitting of e1u(?) level due to the lowering of the symmetry is the only effect observed in the photoelectron spectra.There is a strong conjugation between the phenyl and cyclopentadienyl ?-orbitals in 1,1′-diphenylferrocene.The changes in the a1g(d) ionization energy calculated by the DeltaSCF method using CNDO/2 total energies are in a good agreement with the experimental data.
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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