Anthracene, tetradecahydro-, (4aα,8aα,9aβ,10aα)-

• Formula: C₁₄H₂₄
• Molecular weight: 192.3404
• IUPAC Standard InChI: InChI=1S/C14H24/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h11-14H,1-10H2/t11-,12-,13-,14+/m1/s1 Copy

  
• IUPAC Standard InChIKey: GVJFFQYXVOJXFI-SYQHCUMBSA-N Copy
• CAS Registry Number: 1755-19-7
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
  The 3d structure may be viewed using Java or Javascript.
• Species with the same structure:
  • Perhydroanthracene, (4aα, 8aα, 9aα, 10aβ)-
• Stereoisomers:
  • Anthracene, tetradecahydro-, (4aα,8aα,9aα,10aα)-
  • trans-anti-trans-Tetra-decahydroanthracene
  • Perhydroanthracene, (4aα, 8aβ, 9aα, 10aβ)-
  • Anthracene, tetradecahydro-
  • Tricyclo[8.4.0.0(3,8)]dodecane, isomer # 1
  • Tricyclo[8.4.0.0(3,8)]dodecane, isomer # 2
  • Tricyclo[8.4.0.0(3,8)]dodecane, isomer # 3
  • Tricyclo[8.4.0.0(3,8)]dodecane, isomer # 4
  • Tricyclo[8.4.0.0(3,8)]dodecane, isomer # 5
• Other names: Anthracene, 1,2,3,4,4aα,5,6,7,8,8aβ,9,9aβ,10,10aα-tetradecahydro-; trans-syn-trans-Perhydroanthracene; Anthracene, tetradecahydro-, (4aα,8aβ,9aβ,10aα)-; trans-cisoid-trans-Perhydroanthracene
• Information on this page:
  • Phase change data
  • Reaction thermochemistry data
  • Gas phase ion energetics data
  • References
  • Notes
• Other data available:
  • Gas phase thermochemistry data
  • Condensed phase thermochemistry data
  • Mass spectrum (electron ionization)
• Options:
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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

Enthalpy of sublimation

Reaction thermochemistry data

Go To: Top, Phase change data, 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: 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

=

By formula: C₁₄H₂₄ = C₁₄H₂₄

=

By formula: C₁₄H₂₄ = C₁₄H₂₄

=

By formula: C₁₄H₂₄ = C₁₄H₂₄

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

Ionization energy determinations

References

Go To: Top, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, Notes

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

Frisch, 1962
Frisch, M.A., A high precision calorimeter for ther measurement of small energy differences, Ph.D. Thesis for University of Wisconsin, 1962, 1-100. [all data]

Margrave, Frisch, et al., 1963
Margrave, J.L.; Frisch, M.A.; Bautista, R.G.; Clarke, R.L.; Johnson, W.S., Further studies on the energy difference between the chair and twist forms of cyclohexane, J. Am. Chem. Soc., 1963, 85, 546-548. [all data]

Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw, Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2 . [all data]

Cox and Pilcher, 1970
Cox, J.D.; Pilcher, G., Thermochemistry of Organic and Organometallic Compounds, Academic Press Inc., London, 1970, 643. [all data]

Allinger and Wuesthoff, 1971
Allinger, N.L.; Wuesthoff, M.T., Conformational analysis. LXXIII. The perhydroanthracenes. An equilibration study, J. Org. Chem., 1971, 36, 2051-2053. [all data]

Heilbronner, Honegger, et al., 1984
Heilbronner, E.; Honegger, E.; Zambach, W.; Schmitt, P.; Gunther, H., The persistence of ribbon orbitals in polycyclic alkanes, Helv. Chim. Acta, 1984, 67, 1681. [all data]

Notes

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• Symbols used in this document:
  

  ΔrH°	Enthalpy of reaction at standard conditions
  ΔsubH	Enthalpy of sublimation
  ΔsubH°	Enthalpy of sublimation at standard conditions

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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