Disilane, hexamethyl-
- Formula: C6H18Si2
- Molecular weight: 146.3781
- IUPAC Standard InChIKey: NEXSMEBSBIABKL-UHFFFAOYSA-N
- CAS Registry Number: 1450-14-2
- 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: Hexamethyldisilane; (CH3)6Si2; Permethyldisilane; CH7280
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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
Constant pressure heat capacity of liquid
Cp,liquid (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
61.159 | 295.67 | Suga and Seki, 1959 | T = 200 to 300 K. Value is unsmoothed experimental datum. |
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:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
CAL - James S. Chickos, William E. Acree, Jr., Joel F. Liebman, Students of Chem 202 (Introduction to the Literature of Chemistry), University of Missouri -- St. Louis
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 386. | K | N/A | Farchan Laboratories, 1990 | BS |
Tboil | 386. | K | N/A | PCR Inc., 1990 | BS |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 287.1 | K | N/A | Takagi, Ishikawa, et al., 1986 | Uncertainty assigned by TRC = 0.1 K; TRC |
Tfus | 287.22 | K | N/A | Takagi, Ishikawa, et al., 1986 | Uncertainty assigned by TRC = 0.05 K; TRC |
Tfus | 287.7 | K | N/A | Suga and Seki, 1959, 2 | Crystal phase 1 phase; Uncertainty assigned by TRC = 0.2 K; TRC |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
8.68 | 320. | EB | Takagi, Ishikawa, et al., 1986, 2 | Based on data from 305. to 387. K.; AC |
8.89 | 288. to 310. | N/A | Suga and Seki, 1959 | See also Takagi, Ishikawa, et al., 1986, 2.; AC |
8.80 | 294. to 334. | N/A | Brockway and Davidson, 1941 | See also Takagi, Ishikawa, et al., 1986, 2.; AC |
Enthalpy of fusion
ΔfusH (kcal/mol) | Temperature (K) | Reference | Comment |
---|---|---|---|
0.722 | 287.7 | Domalski and Hearing, 1996 | AC |
Entropy of fusion
ΔfusS (cal/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
10.50 | 221.8 | Domalski and Hearing, 1996 | CAL |
2.507 | 287.7 |
Enthalpy of phase transition
ΔHtrs (kcal/mol) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
2.330 | 221.8 | crystaline, II | crystaline, I | Suga and Seki, 1959 | DH |
0.7211 | 287.7 | crystaline, I | liquid | Suga and Seki, 1959 | DH |
Entropy of phase transition
ΔStrs (cal/mol*K) | Temperature (K) | Initial Phase | Final Phase | Reference | Comment |
---|---|---|---|---|---|
10.51 | 221.8 | crystaline, II | crystaline, I | Suga and Seki, 1959 | DH |
2.507 | 287.7 | crystaline, I | liquid | Suga and Seki, 1959 | DH |
Gas phase ion energetics data
Go To: Top, Condensed phase thermochemistry data, Phase change data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References, Notes
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
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
8.27 ± 0.05 | PIPECO | Szepes and Baer, 1984 | T = 298K; LBLHLM |
8.27 ± 0.05 | PIPECO | Szepes and Baer, 1984 | T = 0K; LBLHLM |
8.27 ± 0.05 | PIPECO | Szepes and Baer, 1984, 2 | T = 0K; LBLHLM |
8.4 | PE | Szepes, Koranyi, et al., 1981 | LLK |
8.0 | PE | Potzinger, Ritter, et al., 1975 | LLK |
8.35 ± 0.12 | EI | Lappert, Pedley, et al., 1971 | LLK |
8.46 ± 0.15 | EI | Gaidis, Briggs, et al., 1971 | LLK |
8.00 ± 0.01 | EI | Pitt, Bursey, et al., 1970 | RDSH |
8.35 ± 0.12 | EI | Lappert, Simpson, et al., 1969 | RDSH |
8.79 ± 0.08 | EI | Hess, Lampe, et al., 1965 | RDSH |
8.68 | PE | Mochida, Worley, et al., 1985 | Vertical value; LBLHLM |
8.7 ± 0.05 | PE | Szepes, Koranyi, et al., 1981 | Vertical value; LLK |
8.69 | PE | Khvostenko, Zykov, et al., 1981 | Vertical value; LLK |
8.69 | PE | Bock and Ensslin, 1971 | Vertical value; LLK |
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
C3H9Si+ | 9.8 ± 0.1 | C3H9Si | PIPECO | Szepes and Baer, 1984 | T = 0K; LBLHLM |
C3H9Si+ | 9.9 | (CH3)3Si | EI | Potzinger, Ritter, et al., 1975 | LLK |
C3H9Si+ | 10.22 ± 0.18 | (CH3)3Si | EI | Lappert, Pedley, et al., 1971 | LLK |
C3H9Si+ | 10.22 ± 0.18 | ? | EI | Lappert, Simpson, et al., 1969 | RDSH |
C3H9Si+ | 10.0 ± 0.1 | ? | EI | Band, Davidson, et al., Commun. 1967 | RDSH |
C3H9Si+ | 10.0 ± 0.1 | ? | EI | Connor, Finney, et al., 1966 | RDSH |
C3H9Si+ | 10.69 ± 0.04 | ? | EI | Hess, Lampe, et al., 1964 | RDSH |
C5H15Si2+ | 9.6 ± 0.1 | CH3 | PIPECO | Szepes and Baer, 1984 | T = 0K; LBLHLM |
C5H15Si2+ | 9.6 ± 0.1 | CH3 | PIPECO | Szepes and Baer, 1984, 2 | T = 0K; LBLHLM |
C5H15Si2+ | 10.74 ± 0.08 | CH3 | EI | Hess, Lampe, et al., 1965 | RDSH |
IR Spectrum
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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: Coblentz Society, Inc.
Condensed Phase Spectrum
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Notice: Except where noted, spectra from this collection were measured on dispersive instruments, often in carefully selected solvents, and hence may differ in detail from measurements on FTIR instruments or in other chemical environments. More information on the manner in which spectra in this collection were collected can be found here.
Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.
Additional Data
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Owner | Copyright (C) 1987 by the Coblentz Society Collection (C) 2018 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | DOW CORNING CORP. |
Source reference | COBLENTZ NO. 5542 |
Date | 1965/11/10 |
Name(s) | 1,1,1,2,2,2-hexamethyldisilane |
State | SOLUTION (10% CCl4 FOR 3800-1300, 2% CS2 FOR 1300-650, AND 10% CCl4 FOR 650-250) |
Instrument | PERKIN-ELMER 521 (GRATING) |
Instrument parameters | FILTERS AT 3150, 2500, 2000, 1150, 700, 410. GRATING CHANGES: 2000, 630 |
Path length | 0.010 CM, 0.011 CM, AND 0.010 CM |
Resolution | 2 |
Boiling point | 113 C |
Mass spectrum (electron ionization)
Go To: Top, Condensed phase thermochemistry data, Phase change data, Gas phase ion energetics data, IR Spectrum, Gas Chromatography, References, Notes
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
View image of digitized spectrum (can be printed in landscape orientation).
Due to licensing restrictions, this spectrum cannot be downloaded.
Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | Japan AIST/NIMC Database- Spectrum MS-NW-9254 |
NIST MS number | 236663 |
Gas Chromatography
Go To: Top, Condensed phase thermochemistry data, Phase change data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), References, Notes
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
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Packed | C78, Branched paraffin | 130. | 686.1 | Dallos, Sisak, et al., 2000 | He; Column length: 3.3 m |
Packed | C78, Branched paraffin | 130. | 685.9 | Reddy, Dutoit, et al., 1992 | Chromosorb G HP; Column length: 3.3 m |
Normal alkane RI, non-polar column, temperature ramp
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | Squalane | 698. | Szekely, Nefedov, et al., 1967 | Nitrogen, 5. K/min; Column length: 50. m; Column diameter: 0.25 mm; Tstart: 60. C; Tend: 250. C |
Normal alkane RI, non-polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | Squalane | 699. | Szekely, Nefedov, et al., 1967 | Nitrogen; Column length: 50. m; Column diameter: 0.25 mm; Program: not specified |
References
Go To: Top, Condensed phase thermochemistry data, Phase change data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Suga and Seki, 1959
Suga, H.; Seki, S.,
On the phase transition of hexamethyldisilane,
Bull. Chem. Soc. Japan, 1959, 32, 1088-1093. [all data]
Farchan Laboratories, 1990
Farchan Laboratories,
Research Chemicals Catalog, Farchan Laboratories, Gainesville, FL, 1990, 91. [all data]
PCR Inc., 1990
PCR Inc.,
Research Chemicals Catalog 1990-1991, PCR Inc., Gainesville, FL, 1990, 1. [all data]
Takagi, Ishikawa, et al., 1986
Takagi, S.; Ishikawa, M.; Kumada, M.; Kimura, T.; Fujishiro, R.,
Vapor Pressure and Thermo. Prop. of Hexamethyldisilane at 305-387 K,
Thermochim. Acta, 1986, 109, 55. [all data]
Suga and Seki, 1959, 2
Suga, H.; Seki, S.,
On the phase transition of hexamethyldisilane,
Bull. Chem. Soc. Jpn., 1959, 32, 1088. [all data]
Takagi, Ishikawa, et al., 1986, 2
Takagi, Sadao; Ishikawa, Mitsuo; Kumada, Makoto; Kimura, Takayoshi; Fujishiro, Ryoichi,
Vapour pressure and thermodynamic properties of hexamethyldisilane at 305--387 K,
Thermochimica Acta, 1986, 109, 1, 55-61, https://doi.org/10.1016/0040-6031(86)85007-9
. [all data]
Brockway and Davidson, 1941
Brockway, L.O.; Davidson, N.R.,
The Molecular Structures of the Dimers of Aluminum Dimethyl Chloride, Aluminum Dimethyl Bromide, and Aluminum Trimethyl and of Hexamethyldisilane,
J. Am. Chem. Soc., 1941, 63, 12, 3287-3297, https://doi.org/10.1021/ja01857a018
. [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]
Szepes and Baer, 1984
Szepes, L.; Baer, T.,
Dissociation dynamics of energy selected hexamethyldisilane ions and the heats of formation of (CH3)3Si+ and (CH3)3Si,
J. Am. Chem. Soc., 1984, 106, 273. [all data]
Szepes and Baer, 1984, 2
Szepes, L.; Baer, T.,
(CH3)3SiX tipusu vegyuletek vizsgalata fotoelectron-fotoion koincidenciaval,I. Meghatarozott belso energiaju hexametil-diszilan-ionok disszociaciojanak dinamikaja,
Magy. Kem. Foly., 1984, 90, 104. [all data]
Szepes, Koranyi, et al., 1981
Szepes, L.; Koranyi, T.; Naray-Szabo, G.; Modelli, A.; Distefano, G.,
Ultraviolet photoelectron spectra of group IV hexamethyl derivatives containing a metal-metal bond,
J. Organomet. Chem., 1981, 217, 35. [all data]
Potzinger, Ritter, et al., 1975
Potzinger, P.; Ritter, A.; Krause, J.,
Massenspektrometrische Bestimmung von Bindungsenergien in siliciumorganischen Verbindungen,
Z. Naturforsch. A:, 1975, 30, 347. [all data]
Lappert, Pedley, et al., 1971
Lappert, M.F.; Pedley, J.B.; Simpson, J.; Spalding, T.R.,
Bonding studies of compounds of boron and the Group IV elements. VI. Mass spectrometric studies on compounds Me4M and Me3M-M'Me3 (M and M'=C, Si, Ge, Sn, and Pb): thermochemical data,
J. Organomet. Chem., 1971, 29, 195. [all data]
Gaidis, Briggs, et al., 1971
Gaidis, J.M.; Briggs, P.R.; Shannon, T.W.,
Mass spectra of disilanes. Phenyl-silicon interaction and silicon-silicon bond strength,
J. Phys. Chem., 1971, 75, 974. [all data]
Pitt, Bursey, et al., 1970
Pitt, C.G.; Bursey, M.M.; Rogerson, P.F.,
Catenates of the group IV elements. Correlation of σ electron energies,
J. Am. Chem. Soc., 1970, 92, 519. [all data]
Lappert, Simpson, et al., 1969
Lappert, M.F.; Simpson, J.; Spalding, T.R.,
Bonding studies of compounds of the group IV elements: ionisation potentials of the Me3M radicals,
J.Organometal. Chem., 1969, 17, PI. [all data]
Hess, Lampe, et al., 1965
Hess, G.G.; Lampe, F.W.; Sommer, L.H.,
An electron impact study of ionization and dissociation of trimethylsilanes,
J. Am. Chem. Soc., 1965, 87, 5327. [all data]
Mochida, Worley, et al., 1985
Mochida, K.; Worley, S.; Kochi, J.,
UV photoelectron spectra of peralkylated catenates of Group 4B elements (silicon, germanium, and tin),
Bull. Chem. Soc. Jpn., 1985, 58, 3389. [all data]
Khvostenko, Zykov, et al., 1981
Khvostenko, V.I.; Zykov, B.G.; Yuriev, V.P.; Mironov, V.F.; Kovel'zon, G.I.; Panasenko, A.A.; Sheludyakov, V.D.; Gailyunas, I.A.,
Study of d(π)-p(π) interaction in vinyl- and alkylsilicon-containing compounds by photoelectron spectroscopy,
J. Organomet. Chem., 1981, 218, 155. [all data]
Bock and Ensslin, 1971
Bock, H.; Ensslin, W.,
Bond-bond interaction in polysilanes,
Angew. Chem. Int. Ed. Engl., 1971, 10, 404. [all data]
Band, Davidson, et al., Commun. 1967
Band, S.J.; Davidson, I.M.T.; Lambert, C.A.; Stephenson, I.L.,
Bond dissociation energies and heats of formation of trimethylsilyl compounds,
Chem., Commun. 1967, 723. [all data]
Connor, Finney, et al., 1966
Connor, J.A.; Finney, G.; Leigh, G.J.; Haszeldine, R.N.; Robinson, P.J.; Sedgwick, R.D.; Simmons, R.F.,
Bond dissociation energies in organosilicon compounds,
Chem. Commun., 1966, 178. [all data]
Hess, Lampe, et al., 1964
Hess, G.G.; Lampe, F.W.; Sommer, L.H.,
Bond dissociation energies and ion energetics in organosilicon compounds by electron impact,
J. Am. Chem. Soc., 1964, 86, 3174. [all data]
Dallos, Sisak, et al., 2000
Dallos, A.; Sisak, A.; Kulcsár, Z.; Kováts, E.,
Pair-wise interactions by gas chromatography VII. Interaction free enthalpies of solutes with secondary alcohol groups,
J. Chromatogr. A, 2000, 904, 2, 211-242, https://doi.org/10.1016/S0021-9673(00)00908-0
. [all data]
Reddy, Dutoit, et al., 1992
Reddy, K.S.; Dutoit, J.-Cl.; Kovats, E. sz.,
Pair-wise interactions by gas chromatography. I. Interaction free enthalpies of solutes with non-associated primary alcohol groups,
J. Chromatogr., 1992, 609, 1-2, 229-259, https://doi.org/10.1016/0021-9673(92)80167-S
. [all data]
Szekely, Nefedov, et al., 1967
Szekely, T.; Nefedov, O.M.; Garzo, G.; Shiryayav, V.I.; Fritz, D.,
Gas chromatographic investigation of the thermal decomposition of polydimethylsilylene,
Acta Chim. Acad. Sci. Hung., 1967, 54, 3-4, 241-254. [all data]
Notes
Go To: Top, Condensed phase thermochemistry data, Phase change data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References
- Symbols used in this document:
AE Appearance energy Cp,liquid Constant pressure heat capacity of liquid Tboil Boiling point Tfus Fusion (melting) point ΔHtrs Enthalpy of phase transition ΔStrs Entropy of phase transition ΔfusH Enthalpy of fusion ΔfusS Entropy of fusion ΔvapH Enthalpy of vaporization - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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