11-Azabicyclo[4.4.1]undeca-1,3,5,7,9-pentaene


Gas phase thermochemistry 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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Δfgas87.8 ± 0.7kcal/molCcbBremser, Hagen, et al., 1969 

Condensed phase thermochemistry 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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Δfliquid73.6 ± 0.6kcal/molCcbBremser, Hagen, et al., 1969 
Quantity Value Units Method Reference Comment
Δcliquid-1321.52kcal/molCcbBremser, Hagen, et al., 1969 

Phase change 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:
BS - Robert L. Brown and Stephen E. Stein
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DRB - Donald R. Burgess, Jr.

Quantity Value Units Method Reference Comment
Tfus289.KN/ABuckingham and Donaghy, 1982BS
Quantity Value Units Method Reference Comment
Δvap14.17kcal/molVBremser, Hagen, et al., 1969ALS
Δvap14.1kcal/molN/ABremser, Hagen, et al., 1969DRB

Reduced pressure boiling point

Tboil (K) Pressure (atm) Reference Comment
333. to 334.0.00003Buckingham and Donaghy, 1982BS

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:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard

View reactions leading to C10H9N+ (ion structure unspecified)

Ionization energy determinations

IE (eV) Method Reference Comment
7.75PEAndrea, Cerfontain, et al., 1984LBLHLM
8.01PEAndrea, Cerfontain, et al., 1984Vertical value; LBLHLM

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.

Bremser, Hagen, et al., 1969
Bremser, W.; Hagen, R.; Heilbronner, E.; Vogel, E., 48. Die Bildungsenthalpie 1,6-uberbruckter [10]Annulene, Helv. Chim. Acta, 1969, 52, 418-431. [all data]

Buckingham and Donaghy, 1982
Buckingham, J.; Donaghy, S.M., Dictionary of Organic Compounds: Fifth Edition, Chapman and Hall, New York, 1982, 1. [all data]

Andrea, Cerfontain, et al., 1984
Andrea, R.R.; Cerfontain, H.; Lamberchts, H.J.A.; Louwen, J.N.; Oskam, A., He I and He II photoelectron spectra and CNDO/S and MNDO MO calculations of some bridged [10] annulenes, J. Am. Chem. Soc., 1984, 106, 2531. [all data]


Notes

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