1,4:5,8-Dimethanonaphthalene, 1,2,3,4,4a,5,8,8a-octahydro-, (1α,4α,4aα,5β,8β,8aα)-

• Formula: C₁₂H₁₆
• Molecular weight: 160.2554
• IUPAC Standard InChI: InChI=1S/C12H16/c1-2-8-5-7(1)11-9-3-4-10(6-9)12(8)11/h1-2,7-12H,3-6H2/t7-,8+,9-,10+,11-,12+ Copy

  
• IUPAC Standard InChIKey: XBFJAVXCNXDMBH-CJXDBHJTSA-N Copy
• CAS Registry Number: 36012-52-9
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Stereoisomers:
  • exo,endo-Tetracyclo[6.2.1.1(3,6).0(2,7)]dodec-4-ene
  • 1,4:5,8-Dimethanonaphthalene, 1,2,3,4,4a,5,8,8a-octahydro-, (1α,4α,5β,8β)-
  • 1,4:5,8-dimethano-naphthalene,1,2,4,4a,8,8,8a-octahydro-
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• Information on this page:
  • Reaction thermochemistry data
  • Gas phase ion energetics data
  • References
  • Notes
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Reaction 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

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Individual Reactions

 +  =

By formula: H₂ + C₁₂H₁₆ = C₁₂H₁₈

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
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

References

Go To: Top, 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.

Turner, Jarrett, et al., 1973
Turner, R.B.; Jarrett, A.D.; Goebel, P.; Mallon, B.J., Heats of hydrogenation. 9. Cyclic acetylenes and some miscellaneous olefins, J. Am. Chem. Soc., 1973, 95, 790-792. [all data]

Paddon-Row, Patney, et al., 1982
Paddon-Row, M.N.; Patney, H.K.; Brown, R.S., Orbital interactions. XI. Application of photoelectron spectroscopy to the study of orbital interactions in some 2- and 9-substituted octahydrodimethanonaphthalenes, Aust. J. Chem., 1982, 35, 293. [all data]

Paddon-Row, Patney, et al., 1981
Paddon-Row, M.N.; Patney, H.K.; Brown, R.S.; Houk, K.N., Observation of a very large orbital interaction through four bonds. An alternative model of orbital interactions through bonds, J. Am. Chem. Soc., 1981, 103, 5575. [all data]

Notes

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• Symbols used in this document:
  

  ΔrH°	Enthalpy of reaction at standard conditions

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