Borane, triethyl-
- Formula: C6H15B
- Molecular weight: 97.994
- IUPAC Standard InChIKey: LALRXNPLTWZJIJ-UHFFFAOYSA-N
- CAS Registry Number: 97-94-9
- 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: Triethylborane; Triethylboron; (C2H5)3B; Triethylborine; Borethyl
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Condensed phase 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: Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
S°solid,1 bar | 78.884 | cal/mol*K | N/A | Kostryukov, Samorukov, et al., 1977 | |
S°solid,1 bar | 80.81 | cal/mol*K | N/A | Furukawa, 1955 | Below 15°. Debye extrapolation. |
Constant pressure heat capacity of solid
Cp,solid (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
57.4 | 298.15 | Kostryukov, Samorukov, et al., 1977 | T = 12 to 322 K. Data calculated from equation. Cp = 6.2328 + 0.17161 T cal/mol*K. |
57.70 | 300. | Furukawa, 1955 | T = 15 to 300 K. |
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:
DH - Eugene S. Domalski and Elizabeth D. Hearing
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 321.81 | K | N/A | Kostryukov, Samorukov, et al., 1977 | DH |
Quantity | Value | Units | Method | Reference | Comment |
Ttriple | 180.21 | K | N/A | Kostryukov, Samorukov, et al., 1977, 2 | Uncertainty assigned by TRC = 0.05 K; TRC |
Ttriple | 180.3 | K | N/A | Furukawa, 1955, 2 | Uncertainty assigned by TRC = 0.2 K; TRC |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
0.8769 | 300. | Furukawa, 1955 | P = 56.27 mmHg; DH |
8.03 | 293. | House, 1983 | AC |
Entropy of vaporization
ΔvapS (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
29.2 | 300. | Furukawa, 1955 | P; DH |
Antoine Equation Parameters
log10(P) = A − (B / (T + C))
P = vapor pressure (atm)
T = temperature (K)
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Temperature (K) | A | B | C | Reference | Comment |
---|---|---|---|---|---|
273. to 351.0 | 2.90837 | 753.261 | -112.631 | Stock and Zeidler, 1921 | Coefficents calculated by NIST from author's data. |
Enthalpy of fusion
ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
2.7538 | 180.21 | Kostryukov, Samorukov, et al., 1977 | DH |
2.832 | 180.3 | Domalski and Hearing, 1996 | AC |
Entropy of fusion
ΔfusS (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
15.28 | 180.21 | Kostryukov, Samorukov, et al., 1977 | DH |
Enthalpy of phase transition
ΔHtrs (kcal/mol) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
2.8329 | 180.3 | crystaline, I | liquid | Furukawa, 1955 | DH |
Entropy of phase transition
ΔStrs (cal/mol*K) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
15.7 | 180.3 | crystaline, I | liquid | Furukawa, 1955 | DH |
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:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
9.6 | PE | Holliday, Reade, et al., 1971 | LLK |
9.7 ± 0.1 | EI | Lappert, Pedley, et al., 1966 | RDSH |
9.0 ± 0.2 | EI | Law and Margrave, 1956 | RDSH |
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
B+ | 30.1 ± 0.5 | ? | EI | Law and Margrave, 1956 | RDSH |
C4H10B+ | 9.6 ± 0.2 | C2H5 | EI | Law and Margrave, 1956 | RDSH |
References
Go To: Top, Condensed phase thermochemistry data, 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.
Kostryukov, Samorukov, et al., 1977
Kostryukov, V.N.; Samorukov, O.P.; Samorukova, N.Kh.; Krasavin, A.M.; Petrunin, A.B.,
Heat capacity of triethylboron at low temperature,
Vses. Konf. Kalorim. [Russhir. Tezisy Dokl.] 7th, 1977, 2, 387-390. [all data]
Furukawa, 1955
Furukawa, G.T.,
Heat capacity, heats of fusion and vaporization, and vapor pressure of triethylborane, (C2H5)3B,
NBS Report, 1955, No. 3712, 1-16. [all data]
Kostryukov, Samorukov, et al., 1977, 2
Kostryukov, V.N.; Samorukov, O.P.; Samorukova, N.K.; Krasavin, A.M.; Petrunin, A.B.,
Heat capacity of triethylboron at low temperature
in Vses. Konf. Kalorim. [Rasshir. Tezisy Dokl.], 7th, Vol. 2, 387, 1977. [all data]
Furukawa, 1955, 2
Furukawa, G.T.,
Heat capacity, heatsof fusion and vaporization, and vapor pressure of triethylborane, (C2H5)3B, Natl. Bur. Stand., 1955. [all data]
House, 1983
House, J.E.,
Cohesion energies and solubility parameters for triethylboron and diethylzinc,
Thermochimica Acta, 1983, 71, 1-2, 215-218, https://doi.org/10.1016/0040-6031(83)80370-0
. [all data]
Stock and Zeidler, 1921
Stock, A.; Zeidler, F.,
Zur Kenntnis des Bormethyls und Borathyls,
Ber. Dtsch. Chem. Ges., 1921, 54, 3, 531-541, https://doi.org/10.1002/cber.19210540321
. [all data]
Domalski and Hearing, 1996
Domalski, Eugene S.; Hearing, Elizabeth D.,
Heat Capacities and Entropies of Organic Compounds in the Condensed Phase. Volume III,
J. Phys. Chem. Ref. Data, 1996, 25, 1, 1, https://doi.org/10.1063/1.555985
. [all data]
Holliday, Reade, et al., 1971
Holliday, A.K.; Reade, W.; Johnstone, R.A.W.; Neville, A.F.,
Photo-electron spectrum of trivinylboron,
Chem. Commun., 1971, 51. [all data]
Lappert, Pedley, et al., 1966
Lappert, M.F.; Pedley, J.B.; Riley, P.N.K.; Tweedale, A.,
Ionisation potentials and electronic spectra of halogeno- and amino-boranes, and a study of some redistribution reactions,
Chem. Commun., 1966, 788. [all data]
Law and Margrave, 1956
Law, R.W.; Margrave, J.L.,
Mass spectrometer appearance potentials for positive ion fragments from BF3, B(CH3)3, B(C2H5)3, B(OCH3)3, and HB(OCH3)2,
J. Chem. Phys., 1956, 25, 1086. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, Phase change data, Gas phase ion energetics data, References
- Symbols used in this document:
AE Appearance energy Cp,solid Constant pressure heat capacity of solid S°solid,1 bar Entropy of solid at standard conditions (1 bar) Tboil Boiling point Ttriple Triple point temperature ΔHtrs Enthalpy of phase transition ΔStrs Entropy of phase transition ΔfusH Enthalpy of fusion ΔfusS Entropy of fusion ΔvapH Enthalpy of vaporization ΔvapS Entropy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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