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:
  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.
• Other names: m-Carborane; 1,7-Dicarbadodecaborane; m-Barene; m-Decarborocarborane; m-Dicarbadodecaborane; Neobarene; Neocarborane
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• Information on this page:
  • Phase change data
  • Gas phase ion energetics data
  • References
  • Notes
• Other data available:
  • Condensed phase thermochemistry data
  • Mass spectrum (electron ionization)
  • Gas Chromatography
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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:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
DH - Eugene S. Domalski and Elizabeth D. Hearing

Enthalpy of sublimation

Enthalpy of phase transition

Entropy of phase transition

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

References

Go To: Top, Phase change 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.

Gorbunov, Zalukaev, et al., 1981
Gorbunov, V.E.; Zalukaev, V.L.; Gavrichev, K.S.; Mochalov, V.I.; Gal'chenko, G.L., Low-temperature heat capacity of 1,7-carborane(12)(m-carborane), Termodin. Org. Soedin., 1981, 1981, 3. [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]

Pilcher and Skinner, 1983
Pilcher, G.; Skinner, H.A., Thermochemistry of organometallic compounds, 1983, 43-90, https://doi.org/10.1002/9780470771686.ch2 . [all data]

Miroshnichenko, Pavlovich, et al., 1976
Miroshnichenko, E.A.; Pavlovich, V.K.; Lebedev, Yu.A.; Stanko, V.I.; Gal'chenko, G.L., Microcalorimetric determination of enthalpies of sublimation of carboranes, Termodin. Org. Soedin, 1976, 5, 3. [all data]

Gorbunov, Zalukaev, et al., 1981, 2
Gorbunov, V.E.; Zalukaev, V.L.; Gavrichev, K.S.; Mochalov, V.I.; Gal'chenko, G.L., Low-temperature heat capacity of 1, 7-carborane(12) (m-carborane), 1981, Termodin. [all data]

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]

Notes

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• Symbols used in this document:
  

  Ttriple	Triple point temperature
  ΔHtrs	Enthalpy of phase transition
  ΔStrs	Entropy of phase transition
  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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