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Benzene, 1-azido-4-nitro-

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Gas phase thermochemistry data

Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Mass spectrum (electron ionization), 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Deltafgas93.1 ± 1.2kcal/molCcbFinch, Gardner, et al., 1997 

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
Deltafsolid73.8 ± 1.0kcal/molCcbFinch, Gardner, et al., 1997 
Quantity Value Units Method Reference Comment
Deltacsolid-774.7 ± 1.0kcal/molCcbFinch, Gardner, et al., 1997 

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:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos

Quantity Value Units Method Reference Comment
Deltasub19. ± 0.7kcal/molEFinch, Gardner, et al., 1997ALS

Enthalpy of fusion

DeltafusH (kcal/mol) Temperature (K) Method Reference Comment
4.09345.4DSCFinch, Gardner, et al., 1997AC

Reaction thermochemistry data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Mass spectrum (electron ionization), 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

Benzene, 1-azido-4-nitro- + endo-Dicyclopentadiene = C16H16N4O2

By formula: C6H4N4O2 + C10H12 = C16H16N4O2

Quantity Value Units Method Reference Comment
Deltar-36.1kcal/molCmSamuilov, Movchan, et al., 1985solid phase; solvent: Chlorobenzene

Pyrrolidine, 1-(1-cyclohexen-1-yl)- + Benzene, 1-azido-4-nitro- = C16H21O2

By formula: C10H17N + C6H4N4O2 = C16H21O2

Quantity Value Units Method Reference Comment
Deltar-24.kcal/molCmSamuilov, Movchan, et al., 1985solid phase; solvent: Toluene

Mass spectrum (electron ionization)

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry 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 MINISTRY OF DEFENCE ERDE, WALTHAM ABBEY, ESSEX, UK
NIST MS number 39089

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References

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry 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.

Finch, Gardner, et al., 1997
Finch, A.; Gardner, P.J.; Head, A.J.; Xiaoping, W., The enthalpy of formation of 4-nitrophenyl azide, Thermochim. Acta, 1997, 298, 191-194. [all data]

Samuilov, Movchan, et al., 1985
Samuilov, Ya.D.; Movchan, A.I.; Solov'eva, S.E.; Konovalov, A.I., Thermochemical and kinetic study of 1,3-dipolar cycloadditions involving aryl azides and nitrones, Zh. Org. Khim., 1985, 21, 1772-1776. [all data]


Notes

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Mass spectrum (electron ionization), References