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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

Mass spectrum (electron ionization)

Go To: Top, Gas phase ion energetics data, References, Notes

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

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Owner NIST Mass Spectrometry Data Center
Collection (C) 2014 copyright by the U.S. Secretary of Commerce
on behalf of the United States of America. All rights reserved.
Origin D.HENNEBERG, MAX-PLANCK INSTITUTE, MULHEIM, WEST GERMANY
NIST MS number 63932

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References

Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), Notes

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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