6533b835fe1ef96bd12a0126

RESEARCH PRODUCT

He-I and He-II excited photoelectron spectra of cyclohepttatrienetricarbonyl complexes of group via metals

Enrico CilibertoG. DeganelloGaetano GranozziIgnazio L. Fragalà

subject

LigandChemistryOrganic ChemistryRelaxation (NMR)BiochemistrySpectral lineInorganic ChemistryMetalAtomic orbitalIonizationExcited statevisual_artMaterials Chemistryvisual_art.visual_art_mediumPhysical chemistryPhysical and Theoretical ChemistryIonization energyAtomic physics

description

Abstract Photoelectron spectra of Group VIA metal complexes M(CO) 3 (η 6 -C 7 H 8 ) have been assigned using experimental criteria along with quantum-mechanical calculations. A general agreement between computed and measured ionization energies has been found for molecular orbitas mainly ligand in character. Similar correlations do not hold for the highest orbitals, mainly metal d based. The energies associated with ionization processes are, in this case, largely dominated by the relaxation terms. The variations of intensities of these bands on changing the energy of ionizing radiation were of crucial significance in the assignment

10.1016/s0022-328x(00)83940-6http://hdl.handle.net/20.500.11769/17978