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Carbon Tetrachloride

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Gas phase thermochemistry data

Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, 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:
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Deltafgas-25. ± 5.kcal/molAVGN/AAverage of 6 values; Individual data points
Quantity Value Units Method Reference Comment
gas,1 bar74.008cal/mol*KReviewChase, 1998Data last reviewed in December, 1968

Gas Phase Heat Capacity (Shomate Equation)

Cp° = A + B*t + C*t2 + D*t3 + E/t2
H° − H°298.15= A*t + B*t2/2 + C*t3/3 + D*t4/4 − E/t + F − H
S° = A*ln(t) + B*t + C*t2/2 + D*t3/3 − E/(2*t2) + G
    Cp = heat capacity (cal/mol*K)
    H° = standard enthalpy (kcal/mol)
    S° = standard entropy (cal/mol*K)
    t = temperature (K) / 1000.

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View table.

Temperature (K) 298. - 6000.
A 24.64469
B 1.001110
C -0.269234
D 0.022867
E -0.458801
F -31.86800
G 100.9640
H -22.94000
ReferenceChase, 1998
Comment Data last reviewed in December, 1968

Condensed phase thermochemistry data

Go To: Top, Gas phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, 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:
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Deltafliquid-30.62 ± 0.60kcal/molReviewManion, 2002adopted combustion calorimetry data of Hu and Sinke, 1969 with increased uncertainty to reflect other data; DRB
Deltafliquid-30.69kcal/molCcrHu and Sinke, 1969, 2ALS
Quantity Value Units Method Reference Comment
Deltacliquid-86.02kcal/molCcrHu and Sinke, 1969, 2ALS
Deltacliquid-87.4 ± 2.0kcal/molCcbSmith, Bjellerup, et al., 1953Reanalyzed by Cox and Pilcher, 1970, Original value = -87. ± 3. kcal/mol; ALS
Quantity Value Units Method Reference Comment
liquid51.240cal/mol*KN/AHicks, Hooley, et al., 1944DH
liquid49.09cal/mol*KN/ALatimer, 1922DH
liquid52.39cal/mol*KN/AStull, 1937Extrapolation below 91 K; 74.31 J/mol*K.; DH

Constant pressure heat capacity of liquid

Cp,liquid (cal/mol*K) Temperature (K) Reference Comment
31.38298.15Shehatta, 1993DH
31.871298.15Lainez, Rodrigo, et al., 1989DH
31.79298.15Petrov, Peshekhodov, et al., 1989T = 258.15, 278.15, 298.15, 318.15 K.; DH
31.76298.15Nkinamubanzi, Charlet, et al., 1985DH
31.391298.15Tanaka, 1982T = 293.15, 298.15, 303.15 K. Data at three temperatures.; DH
31.02293.15Atalla, El-Sharkawy, et al., 1981DH
31.45298.15Grolier, Hamedi, et al., 1979DH
31.405298.15Vesely, Zabransky, et al., 1979DH
31.396298.15Wilhelm, Faradjzadeh, et al., 1979DH
31.446298.15Grolier, Wilhelm, et al., 1978DH
31.405298.15Vesely, Svoboda, et al., 1977T = 298 to 318 K.; DH
31.396298.15Fortier, Benson, et al., 1976DH
31.4056298.15Fortier and Benson, 1976DH
31.52298.15Grolier, Benson, et al., 1975DH
31.467293.15Wilhelm, Zettler, et al., 1974T = 273 to 323 K.; DH
31.26298.15Subrahmanyam and Rajagopal, 1973T = 298 to 323 K.; DH
31.50256.10Arentsen and Van Miltenburg, 1972T = 243 to 256 K. Value is unsmoothed experimental datum.; DH
31.31298.Deshpande and Bhatagadde, 1971T = 298 to 318 K.; DH
31.43293.Rastorguev and Ganiev, 1967T = 293 to 333 K.; DH
31.29300.Harrison and Moelwyn-Hughes, 1957T = 243 to 303 K.; DH
31.19303.3Harrison and Moelwyn-Hughes, 1957T = 254 to 303 K. Unsmoothed experimental datum.; DH
31.690298.Staveley, Tupman, et al., 1955T = 295 to 339 K.; DH
30.78298.Kurbatov, 1948T = -20 to 72°C. Mean Cp, four temperatures.; DH
31.470298.15Hicks, Hooley, et al., 1944T = 15 to 300 K.; DH
31.60298.1Zhdanov, 1941T = 5 to 46°C.; DH
31.81301.2Phillip, 1939DH
31.699298.1Stull, 1937T = 90 to 320 K.; DH
31.81298.Vold, 1937DH
31.79298.Vold, 1937Cp given as 0.2066 cal/g*K.; DH
30.21288.3Kolosovskii and Udovenko, 1934DH
30.21288.3de Kolossowsky and Udowenko, 1933DH
31.19298.1Richards and Wallace, 1932T = 293 to 323 K.; DH
30.59293.2Williams and Daniels, 1925T = 20 to 50°C.; DH
30.81303.Willams and Daniels, 1924T = 303 to 330 K. Equation only.; DH
32.00290.Latimer, 1922T = 39.1 to 290 K.; DH

Constant pressure heat capacity of solid

Cp,solid (cal/mol*K) Temperature (K) Reference Comment
10.5746.Atake and Chihara, 1971T = 3 to 46 K.; DH

Phase change data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, 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:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny, director
BS - Robert L. Brown and Stephen E. Stein
DRB - Donald R. Burgess, Jr.
AC - William E. Acree, Jr., James S. Chickos
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
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
Tboil349.8 ± 0.3KAVGN/AAverage of 82 out of 89 values; Individual data points
Quantity Value Units Method Reference Comment
Tfus250.3 ± 0.3KAVGN/AAverage of 31 out of 37 values; Individual data points
Quantity Value Units Method Reference Comment
Ttriple249. ± 3.KAVGN/AAverage of 7 values; Individual data points
Quantity Value Units Method Reference Comment
Tc556.36KN/AAltunin, Geller, et al., 1987Uncertainty assigned by TRC = 0.2 K; TRC
Tc556.4KN/AMajer and Svoboda, 1985 
Tc556.3KN/ACampbell and Chatterjee, 1969Uncertainty assigned by TRC = 0.2 K; TRC
Tc558.35KN/ALivingston, Morgan, et al., 1908Uncertainty assigned by TRC = 5. K; calculation based on extrap. of density and surface tension; TRC
Quantity Value Units Method Reference Comment
Pc44.34atmN/AAltunin, Geller, et al., 1987Uncertainty assigned by TRC = 0.49 atm; TRC
Pc44.980atmN/ACampbell and Chatterjee, 1969Uncertainty assigned by TRC = 0.09998 atm; TRC
Quantity Value Units Method Reference Comment
rhoc3.62mol/lN/ACampbell and Chatterjee, 1969Uncertainty assigned by TRC = 0.02 mol/l; TRC
rhoc3.625mol/lN/AKordes, 1954Uncertainty assigned by TRC = 0.02 mol/l; TRC
rhoc3.625mol/lN/ALewis, 1953Uncertainty assigned by TRC = 0.03 mol/l; TRC
Quantity Value Units Method Reference Comment
Deltavap7.7 ± 0.4kcal/molAVGN/AAverage of 7 values; Individual data points

Enthalpy of vaporization

DeltavapH (kcal/mol) Temperature (K) Method Reference Comment
7.127349.9N/AMajer and Svoboda, 1985 
7.27364.AStephenson and Malanowski, 1987Based on data from 349. - 416. K.; AC
6.98427.AStephenson and Malanowski, 1987Based on data from 412. - 497. K.; AC
7.31509.AStephenson and Malanowski, 1987Based on data from 494. - 555. K.; AC
8.05277.A,EBStephenson and Malanowski, 1987Based on data from 262. - 349. K. See also Boublík and Aim, 1972.; AC
7.72308.N/AHildenbrand and McDonald, 1959Based on data from 293. - 351. K.; AC
7.58325.N/ABarker, Brown, et al., 1953Based on data from 313. - 338. K.; AC

Enthalpy of vaporization

ΔvapH = A exp(-βTr) (1 − Tr)β
    ΔvapH = Enthalpy of vaporization (at saturation pressure) (kcal/mol)
    Tr = reduced temperature (T / Tc)

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Temperature (K) A (kcal/mol) beta Tc (K) Reference Comment
298. - 358.10.960.2656556.4Majer and Svoboda, 1985 

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
293.03 - 350.864.017201221.781-45.739Hildenbrand and McDonald, 1959, 2Coefficents calculated by NIST from author's data.

Enthalpy of sublimation

DeltasubH (kcal/mol) Temperature (K) Method Reference Comment
9.06227. - 248.N/AGoto, Fujinawa, et al., 1996AC
10.3226.BBondi, 1963AC
9.27217.N/AJones, 1960Based on data from 209. - 225. K. See also Goto, Fujinawa, et al., 1996.; AC

Enthalpy of fusion

DeltafusH (kcal/mol) Temperature (K) Reference Comment
0.643249.Domalski and Hearing, 1996AC

Entropy of fusion

DeltafusS (cal/mol*K) Temperature (K) Reference Comment
4.897224.6Domalski and Hearing, 1996CAL
2.586249.
4.85225.4
2.41250.3
4.90225.7
2.44250.5

Enthalpy of phase transition

DeltaHtrs (kcal/mol) Temperature (K) Initial Phase Final Phase Reference Comment
1.107225.7crystaline, IIcrystaline, IMorrison and Richards, 1976DH
0.6123250.53crystaline, IliquidMorrison and Richards, 1976DH
0.4417245.70crystaline, IIliquidArentsen and Van Miltenburg, 1972DH
0.6185250.28crystaline, IliquidArentsen and Van Miltenburg, 1972Stable phase.; DH
1.095225.35crystaline, IIcrystaline, IChang and Westrum, 1970DH
0.6011250.3crystaline, IliquidChang and Westrum, 1970DH
1.095225.35crystaline, IIcrystaline, IHicks, Hooley, et al., 1944DH
0.6011250.3crystaline, IliquidHicks, Hooley, et al., 1944DH
1.099224.6crystaline, IIcrystaline, ILatimer, 1922DH
0.6439249.crystaline, IliquidLatimer, 1922DH
1.100225.63crystaline, IIcrystaline, IStull, 1937DH
0.5810250.37crystaline, IliquidStull, 1937DH

Entropy of phase transition

DeltaStrs (cal/mol*K) Temperature (K) Initial Phase Final Phase Reference Comment
4.904225.7crystaline, IIcrystaline, IMorrison and Richards, 1976DH
2.4441250.53crystaline, IliquidMorrison and Richards, 1976DH
1.80245.70crystaline, IIliquidArentsen and Van Miltenburg, 1972DH
2.443250.28crystaline, IliquidArentsen and Van Miltenburg, 1972Stable; DH
4.859225.35crystaline, IIcrystaline, IChang and Westrum, 1970DH
2.400250.3crystaline, IliquidChang and Westrum, 1970DH
4.859225.35crystaline, IIcrystaline, IHicks, Hooley, et al., 1944DH
2.402250.3crystaline, IliquidHicks, Hooley, et al., 1944DH
4.90224.6crystaline, IIcrystaline, ILatimer, 1922DH
2.58249.crystaline, IliquidLatimer, 1922DH
6.310225.63crystaline, IIcrystaline, IStull, 1937DH
2.32250.37crystaline, IliquidStull, 1937DH

In addition to the Thermodynamics Research Center (TRC) data available from this site, much more physical and chemical property data is available from the following TRC products:


Reaction thermochemistry data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, 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:
B - John E. Bartmess
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias
MS - José A. Martinho Simões
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. A general reaction search form is also available. Future versions of this site may rely on reaction search pages in place of the enumerated reaction displays seen below.

Individual Reactions

Chlorine anion + Carbon Tetrachloride = (Chlorine anion bullet Carbon Tetrachloride)

By formula: Cl- + CCl4 = (Cl- bullet CCl4)

Quantity Value Units Method Reference Comment
Deltar13.4 ± 2.0kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B
Deltar14.20 ± 0.70kcal/molTDAsDougherty, Dalton, et al., 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Deltar27.8cal/mol*KHPMSDougherty, Dalton, et al., 1974gas phase; M
Quantity Value Units Method Reference Comment
Deltar5.05kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B
Deltar5.90 ± 0.90kcal/molTDAsDougherty, Dalton, et al., 1974gas phase; B

C8H6MoO3 (solution) + Carbon Tetrachloride (solution) = Molybdenum, tricarbonylchloro(η5-2,4-cyclopentadien-1-yl)- (solution) + Trichloromethane (solution)

By formula: C8H6MoO3 (solution) + CCl4 (solution) = C8H5ClMoO3 (solution) + CHCl3 (solution)

Quantity Value Units Method Reference Comment
Deltar-31.81 ± 0.91kcal/molRSCNolan, López de la Vega, et al., 1986solvent: Tetrahydrofuran; The enthalpy of solution of Mo(Cp)(CO)3(H)(cr) was measured as 2.1 ± 0.1 kcal/mol Nolan, López de la Vega, et al., 1986, 2. Reaction temperature: 323 K; MS

Carbon dioxide + Carbon Tetrachloride = 2Phosgene

By formula: CO2 + CCl4 = 2CCl2O

Quantity Value Units Method Reference Comment
Deltar16.8 ± 0.5kcal/molEqkLord and Pritchard, 1969gas phase; Two values for Hf; ALS
Deltar16.8 ± 0.5kcal/molEqkLord and Pritchard, 1969gas phase; Two values for Hf; ALS

CCl5- + 2Carbon Tetrachloride = C2Cl9-

By formula: CCl5- + 2CCl4 = C2Cl9-

Quantity Value Units Method Reference Comment
Deltar9.30kcal/molN/AHiraoka, Mizuno, et al., 2001gas phase; B
Quantity Value Units Method Reference Comment
Deltar3.04kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B

Trichloromethane + Chlorine = Carbon Tetrachloride + Hydrogen chloride

By formula: CHCl3 + Cl2 = CCl4 + HCl

Quantity Value Units Method Reference Comment
Deltar-22.30kcal/molCmKirkbride, 1956liquid phase; Heat of chlorination; ALS

Carbon Tetrachloride + Bromine = bromine chloride + Methane, bromotrichloro-

By formula: CCl4 + Br2 = BrCl + CBrCl3

Quantity Value Units Method Reference Comment
Deltar8.8 ± 0.3kcal/molEqkMendenhall, Golden, et al., 1973gas phase; ALS

C10H12Mo (cr) + 2Carbon Tetrachloride (l) = C10H10Cl2Mo (cr) + 2Trichloromethane (l)

By formula: C10H12Mo (cr) + 2CCl4 (l) = C10H10Cl2Mo (cr) + 2CHCl3 (l)

Quantity Value Units Method Reference Comment
Deltar-76.8 ± 1.1kcal/molRSCCalado, Dias, et al., 1979MS

C10H12W (cr) + 2Carbon Tetrachloride (l) = C10H10Cl2W (cr) + 2Trichloromethane (l)

By formula: C10H12W (cr) + 2CCl4 (l) = C10H10Cl2W (cr) + 2CHCl3 (l)

Quantity Value Units Method Reference Comment
Deltar-71.96 ± 0.81kcal/molRSCCalado, Dias, et al., 1979MS

2Phosgene = Carbon dioxide + Carbon Tetrachloride

By formula: 2CCl2O = CO2 + CCl4

Quantity Value Units Method Reference Comment
Deltar-16.8 ± 0.5kcal/molEqkLord and Pritchard, 1969gas phase; ALS

Henry's Law data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, 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: Rolf Sander

Henry's Law constant (water solution)

kH(T) = H exp(d(ln(kH))/d(1/T) ((1/T) - 1/(298.15 K)))
H = Henry's law constant for solubility in water at 298.15 K (mol/kg*bar)
d(ln(kH))/d(1/T) = Temperature dependence constant (K)

H (mol/kg*bar) d(ln(kH))/d(1/T) (K) Method Reference Comment
0.0344200.LN/A 
0.0384100.MN/A 
0.0343600.MN/A 
0.0323400.XN/A 
0.036 MN/A 
0.0383600.XN/A 
0.0304200.MN/A 
0.0314200.XN/A 
0.034 QN/A missing citation give several references for the Henry's law constants but don't assign them to specific species.
0.0285600.XN/A 
0.0354100.MN/A 
0.0334000.XN/A 
0.0334400.MGossett, 1987 
0.0334300.XN/A 
0.0423200.MN/A 
0.0331100.XN/A 
0.0364400.XLeighton and Calo, 1981 
0.051 LN/A 
0.0334700.XN/A 
0.034 VN/A 
0.047 CN/A 
0.035 VN/A 
0.045 MPearson and McConnell, 1975The same data was also published in missing citation. Value at T = 293. K.
0.038 CN/A 
0.0394900.MN/A 

Gas phase ion energetics data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, References, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data evaluated as indicated in comments:
L - Sharon G. Lias

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
LL - Sharon G. Lias and Joel F. Liebman
B - John E. Bartmess

Quantity Value Units Method Reference Comment
IE (evaluated)11.47 ± 0.01eVN/AN/AL

Electron affinity determinations

EA (eV) Method Reference Comment
0.80 ± 0.34IMRBStaneke, Groothuis, et al., 1995EA > EA(CH2S-.), and Cl-A(CCl3.) < Cl-A(CCl4); B
2.00 ± 0.20NBIELacmann, Maneira, et al., 1983B
2.00 ± 0.20NBIEDispert and Lacmann, 1978B
2.12 ± 0.10SIGaines, Kay, et al., 1966The Magnetron method, lacking mass analysis, is not considered reliable.; B

Ionization energy determinations

IE (eV) Method Reference Comment
11.5 ± 0.1EIKime, Driscoll, et al., 1987LBLHLM
11.3PEVon Niessen, Asbrink, et al., 1982LBLHLM
11.47 ± 0.08PEBassett and Lloyd, 1971LLK
11.47PEDewar and Worley, 1969RDSH
11.47 ± 0.01PIWatanabe, 1957RDSH
11.0 ± 1.0EIBaker and Tate, 1938RDSH
11.69PEKimura, Katsumata, et al., 1981Vertical value; LLK
11.69PEDixon, Murrell, et al., 1971Vertical value; LLK

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
C+24. ± 1.4ClPIBurton, Chan, et al., 1994LL
C+23.5 ± 0.24ClEIBaker and Tate, 1938RDSH
CCl+17. ± 1.3ClPIBurton, Chan, et al., 1994LL
CCl+19.35 ± 0.05Cl2+Cl?EIReed and Snedden, 1958RDSH
CCl+19.4 ± 0.1Cl2+Cl?EIBlanchard and LeGoff, 1957RDSH
CCl+17.1 ± 0.23ClEIBaker and Tate, 1938RDSH
CCl2+14. ± 1.Cl2PIBurton, Chan, et al., 1994LL
CCl2+16. ± 1.2ClPIBurton, Chan, et al., 1994LL
CCl2+15.4?EIShapiro and Lossing, 1968RDSH
CCl2+16.0 ± 0.22ClEIBaker and Tate, 1938RDSH
CCl3+11. ± 1.ClPIBurton, Chan, et al., 1994LL
CCl3+11.28 ± 0.03ClPIWerner, Tsai, et al., 1974LLK
CCl3+11.37ClEILossing, 1972LLK
CCl3+11.65 ± 0.10ClEIFox and Curran, 1961RDSH
CCl3+11.90 ± 0.07ClEIReed and Snedden, 1958RDSH
CCl3+11.7 ± 0.1ClEIFarmer, Henderson, et al., 1956RDSH
CCl3+12.2 ± 0.2ClEIBaker and Tate, 1938RDSH
Cl+24. ± 1.C+Cl+Cl2PIBurton, Chan, et al., 1994LL
Cl+19. ± 1.CCl+Cl2PIBurton, Chan, et al., 1994LL
Cl+16.1 ± 0.2CCl3EIFox and Curran, 1961RDSH
Cl+19.1 ± 0.2?EIBaker and Tate, 1938RDSH
Cl2+23. ± 1.C+2ClPIBurton, Chan, et al., 1994LL
Cl2+16.4 ± 0.5?EIBaker and Tate, 1938RDSH
Cl2+23.0 ± 1.0C+2ClEIBaker and Tate, 1938RDSH

Ion clustering data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, IR Spectrum, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, 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:
B - John E. Bartmess
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias

Note: Please consider using the reaction search for this species. This page allows searching of all reactions involving this species. Searches may be limited to ion clustering reactions. A general reaction search form is also available.

Clustering reactions

CCl5- + 2Carbon Tetrachloride = C2Cl9-

By formula: CCl5- + 2CCl4 = C2Cl9-

Quantity Value Units Method Reference Comment
Deltar9.30kcal/molN/AHiraoka, Mizuno, et al., 2001gas phase; B
Quantity Value Units Method Reference Comment
Deltar3.04kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B

Chlorine anion + Carbon Tetrachloride = (Chlorine anion bullet Carbon Tetrachloride)

By formula: Cl- + CCl4 = (Cl- bullet CCl4)

Quantity Value Units Method Reference Comment
Deltar13.4 ± 2.0kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B
Deltar14.20 ± 0.70kcal/molTDAsDougherty, Dalton, et al., 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Deltar27.8cal/mol*KHPMSDougherty, Dalton, et al., 1974gas phase; M
Quantity Value Units Method Reference Comment
Deltar5.05kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B
Deltar5.90 ± 0.90kcal/molTDAsDougherty, Dalton, et al., 1974gas phase; B

IR Spectrum

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, References, Notes

Data compiled by: Coblentz Society, Inc.

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

Data compiled by: Pamela M. Chu, Franklin R. Guenther, George C. Rhoderick, and Walter J. Lafferty


Mass spectrum (electron ionization)

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Vibrational and/or electronic energy levels, 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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Mass spectrum
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Additional Data

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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 NIST Mass Spectrometry Data Center, 1998.
NIST MS number 291258

All mass spectra in this site (plus many more) are available from the NIST/EPA/NIH Mass Spectral Library. Please see the following for information about the library and its accompanying search program.


Vibrational and/or electronic energy levels

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering 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: Takehiko Shimanouchi

Symmetry:   Td     Symmetry Number sigma = 12


 Sym.   No   Approximate   Selected Freq.  Infrared   Raman   Comments 
 Species   type of mode   Value   Rating   Value  Phase  Value  Phase

a1 1 Sym str 459  C  ia 458.7 p liq.
e 2 Deg deform 217  C  ia 217.0 dp liq.
f2 3 Deg str 776  E 789 VS gas 790.4 dp liq. FR(«nu»1+«nu»4)
f2 3 Deg str 776  E 768 VS gas 761.7 dp liq. FR(«nu»1+«nu»4)
f2 4 Deg deform 314  C 309.9 W liq. 313.5 dp liq.

Source: Shimanouchi, 1972

Notes

VSVery strong
WWeak
iaInactive
pPolarized
dpDepolarized
FRFermi resonance with an overtone or a combination tone indicated in the parentheses.
C3~6 cm-1 uncertainty
E15~30 cm-1 uncertainty

References

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Chase, 1998
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Hildenbrand and McDonald, 1959
Hildenbrand, D.L.; McDonald, R.A., The Heat of Vaporization and Vapor Pressure of Carbon Tetrachloride; The Entropy from Calorimetric Data., J. Phys. Chem., 1959, 63, 9, 1521-1522, https://doi.org/10.1021/j150579a053 . [all data]

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Hildenbrand and McDonald, 1959, 2
Hildenbrand, D.L.; McDonald, R.A., The Heat of Vaporization and Vapor Pressure of Carbon Tetrachloride; the Entropy from Calorimetric Data, J. Phys. Chem., 1959, 63, 9, 1521-1523, https://doi.org/10.1021/j150579a053 . [all data]

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Notes

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, Gas phase ion energetics data, Ion clustering data, IR Spectrum, Mass spectrum (electron ionization), Vibrational and/or electronic energy levels, References