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th
                               8  Biannual Conference on Chemistry - CHEM 08

                      Photoactivatable Carbon Monoxide Releasing Mn(I)(CO)3

                       Based Complexes: Spectroscopic and Density Functional
                                              Theory Calculations

                          Rabaa M. Khaled,  Nour T. Abdel-Ghani, and Ahmed M. Mansour
                                            *
                      Chemistry Department, Cairo University, Faculty of Science, Gamma Street,
                                               Giza, Cairo 12613, Egypt.

                                                     ABSTRACT
                    Reaction between bromopentacarbonyl manganese(I) and N,N-bidentate Schiff-
                    base ligands, bearing different electron-donating and electron withdrawing
                    groups R = OCH3, Cl and NO2, afforded octahedral complexes of the general
                    formula fac-[MnBr(CO)3(N-N)], which were characterized by different spectral
                    and analytical tools. The observed electronic transitions were assigned with the
                    aid of time-dependent density functional theory calculations. The lowest energy
                    transition was assigned to metal-ligand charge transfer. The influence of the
                    substituent on the photophysical and photochemical properties was systemically
                    studied using UV/Vis. and IR spectroscopy. The dark stability and the photo
                    release process was investigated in two solvents of different coordinating ability.
                    The investigated  carbon monoxide  releasing  molecules  (CORMs) are able to
                    release CO upon the exposure to source light in the range of 365–468 nm. Solution
                    IR spectroscopy showed the formation of intermediate Mn(CO)2 species.







































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