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Iron, tricarbonyl(«eta»4-1,3-cyclobutadiene)-


Gas phase ion energetics data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled as indicated in comments:
LL - Sharon G. Lias and Joel F. Liebman
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

Ionization energy determinations

IE (eV) Method Reference Comment
7.65 ± 0.02PEHall, Hillier, et al., 1975LLK
8.04PEDewar and Worley, 1969RDSH
8.17PEGleiter, Hyla-Kryspin, et al., 1992Vertical value; LL
8.15PEWorley, Webb, et al., 1980Vertical value; LLK
8.1PEUlman, Andersen, et al., 1978Vertical value; LLK

References

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Hall, Hillier, et al., 1975
Hall, M.B.; Hillier, I.H.; Connor, J.A.; Guest, M.F.; Lloyd, D.R., The electronic structure of transition metal complexes containing organic ligands III. Low energy photoelectron spectra ab initio SCF MO calculations of iron tricarbonyl cyclobutadiene, Mol. Phys., 1975, 30, 839. [all data]

Dewar and Worley, 1969
Dewar, M.J.S.; Worley, S.D., Photoelectron spectra of molecules. I. Ionization potentials of some organic molecules and their interpretation, J. Chem. Phys., 1969, 50, 654. [all data]

Gleiter, Hyla-Kryspin, et al., 1992
Gleiter, R.; Hyla-Kryspin, I.; Binger, P.; Regitz, M., Electronic structure of 2,4-di-tert-butyl-«eta»<4>-1,3-diphosphacyclobutadiene complexes with Fe(CO)3 and .eta<5>-C5H5Co. Photoelectron spectra and molecular orbital calculations, Organometallics, 1992, 11, 177. [all data]

Worley, Webb, et al., 1980
Worley, S.D.; Webb, T.R.; Gibson, D.H.; Ong, T.-S., The photoelectron spectra of some iron tricarbonyl complexes of 4«pi»-electron donor ligands, J. Electron Spectrosc. Relat. Phenom., 1980, 18, 189. [all data]

Ulman, Andersen, et al., 1978
Ulman, J.A.; Andersen, E.L.; Fehlner, T.P., Characterization of ferraboranes by ultraviolet photoelectron spectroscopy, J. Am. Chem. Soc., 1978, 100, 456. [all data]


Notes

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