Anthracene,9-(1,1-dimethylethyl)-

• Formula: C₁₈H₁₈
• Molecular weight: 234.3355
• IUPAC Standard InChI: InChI=1S/C18H18/c1-18(2,3)17-15-10-6-4-8-13(15)12-14-9-5-7-11-16(14)17/h4-12H,1-3H3 Copy

  
• IUPAC Standard InChIKey: GWJJSVKKSBCHJD-UHFFFAOYSA-N Copy
• CAS Registry Number: 13719-97-6
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Other names: 9-t-Butylanthracene
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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: C₁₈H₁₈ = C₁₈H₁₈

=

By formula: C₁₈H₁₈ = C₁₈H₁₈

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.

Dreeskamp, Kapahnke, et al., 1988
Dreeskamp, H.; Kapahnke, P.; Tochtermann, W., Photo valence isomerization of sterically strained aromatic hydrocarbons: 8,9-dicarbethoxy[6]paracyclophane, Radiat. Phys. Chem., 1988, 32, 537-539. [all data]

Kraljic, Mintas, et al., 1983
Kraljic, I.; Mintas, M.; Klasinc, L.; Ranogajec, F.; Guesten, H., Thermo- and photochemical aspects of the valence isomerization of 9-tert-butylanthracene, Nouv. J. Chim., 1983, 7, 239-243. [all data]

Jahn and Dreeskamp, 1982
Jahn, B.; Dreeskamp, H., Valence isomerization of the 9,10-Dewar isomer to 9-tert-butylanthracene, Z. Naturforsch. A, 1982, 37, 376-379. [all data]

Klasinc, Kovac, et al., 1983
Klasinc, L.; Kovac, B.; Gusten, H., Photoelectron spectra of acenes. Electronic structure and substituent effects, Pure Appl. Chem., 1983, 55, 289. [all data]

Klasinc, Kovac, et al., 1978
Klasinc, L.; Kovac, B.; Schoof, S.; Gusten, H., Photoelectron spectroscopy of 9-substituted anthracenes, Croat. Chem. Acta., 1978, 51, 307. [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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