1,7-Dicarbadodecaborane(12)

• Formula: C₂H₁₂B₁₀
• Molecular weight: 144.227
• IUPAC Standard InChI: InChI=1S/C2H12B10/c1-3-2-4(1,3)6(1)8(2,4)10(2)7(2,3)5(1,3)9(1,6)11(5,7,10)12(6,8,9)10/h1-12H Copy

  
• IUPAC Standard InChIKey: NHBIWBXUPGPZST-UHFFFAOYSA-N Copy
• CAS Registry Number: 16986-24-6
• Chemical structure:
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• Other names: m-Carborane; 1,7-Dicarbadodecaborane; m-Barene; m-Decarborocarborane; m-Dicarbadodecaborane; Neobarene; Neocarborane
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• Information on this page:
  • Gas phase ion energetics data
  • Mass spectrum (electron ionization)
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Condensed phase thermochemistry data
  • Phase change data
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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:
LL - Sharon G. Lias and Joel F. Liebman
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

Mass spectrum (electron ionization)

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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: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Additional Data

Gas Chromatography

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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: NIST Mass Spectrometry Data Center, William E. Wallace, director

Kovats' RI, non-polar column, isothermal

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Kovats' RI, polar column, isothermal

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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.

Orlov, Pustobaev, et al., 1989
Orlov, W.M.; Pustobaev, V.N.; Poroshina, T.Yu.; O'shevskaya, V.A.; Zakharkin, L.I.; Gal'chenko, G.L., Ionization energies of C-monoalkyl substituted ortho- and metacarboranes-12, Dokl. Phys. Chem., 1989, 309, 968, In original 892. [all data]

Orlov, Pustobaev, et al., 1988
Orlov, V.M.; Pustobaev, V.N.; Ol'shevskaya, V.A.; Zakharkin, L.I.; Gal'chenko, G.L., Study of the distribution of electron density in vinyl and aryl derivatives of closo-12-carboranes by photoionization mass specctrometry, Dokl. Phys. Chem., 1988, 300, 518. [all data]

Vondrak, 1987
Vondrak, T., He I photoelectron spectroscopic study of closo-dicarbadodecarboranes and their 9-halogeno derivatives, Tetrahedron, 1987, 6, 1559. [all data]

Fehlner, 1975
Fehlner, T.P., Photoelectron spectroscopy of closo-carboranes. Observation of exo-polyhedral molecular orbitals, Inorg. Chem., 1975, 14, 934. [all data]

Stuchlik and Pacakova, 1979
Stuchlik, J.; Pacakova, V., Gas chromatographic behaviour of some carboranes, J. Chromatogr., 1979, 174, 1, 224-227, https://doi.org/10.1016/S0021-9673(00)87057-0 . [all data]

Notes

Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), Gas Chromatography, References

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