Trichloromethane

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Gas 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 as indicated in comments:
DRB - Donald R. Burgess, Jr.

Quantity Value Units Method Reference Comment
Δfgas-24.661kcal/molReviewChase, 1998Data last reviewed in December, 1968
Δfgas-24.59 ± 0.60kcal/molReviewManion, 2002derived from recommended ΔfHliquid° and ΔvapH°; DRB
Quantity Value Units Method Reference Comment
gas,1 bar70.652cal/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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Temperature (K) 298. to 1200.1200. to 6000.
A 10.5753024.25339
B 27.407600.819731
C -21.22810-0.157110
D 6.1902300.010446
E -0.124954-2.234230
F -29.27560-37.23709
G 75.4648992.53241
H -24.65990-24.65990
ReferenceChase, 1998Chase, 1998
Comment Data last reviewed in December, 1968 Data last reviewed in December, 1968

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 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
Δfliquid-32.05 ± 0.60kcal/molReviewManion, 2002adopted combustion calorimetry data of Hu and Sinke, 1969 with increased uncertainty to reflect other data; DRB
Δfliquid-32.10kcal/molCcrHu and Sinke, 1969, 2ALS
Quantity Value Units Method Reference Comment
Δcliquid-113.10kcal/molCcrHu and Sinke, 1969, 2ALS
Δcliquid-113.3 ± 2.0kcal/molCcbSmith, Bjellerup, et al., 1953Reanalyzed by Cox and Pilcher, 1970, Original value = -113. ± 2. kcal/mol; ALS

Constant pressure heat capacity of liquid

Cp,liquid (cal/mol*K) Temperature (K) Reference Comment
27.306298.15Grolier, Roux-Desgranges, et al., 1993DH
27.06298.15Shehatta, 1993DH
27.323298.15Barta, Kooner, et al., 1989DH
27.330298.15Barta, Kooner, et al., 1989, 2DH
27.61298.15Petrov, Peshekhodov, et al., 1989T = 258.15, 278.15, 298.15, 318.15 K.; DH
27.211298.15Grolier, Roux-Desgranges, et al., 1987DH
27.61298.15Al'per, Peshekhodov, et al., 1986DH
27.182298.15Hepler, Kooner, et al., 1985DH
27.309298.15Inglese, Castagnolo, et al., 1981DH
27.77293.Rastorguev and Ganiev, 1967T = 293 to 333 K.; DH
27.10300.Harrison and Moelwyn-Hughes, 1957T = 243 to 303 K.; DH
27.25303.2Harrison and Moelwyn-Hughes, 1957T = 245 to 303 K. Unsmoothed experimental datum.; DH
27.290298.Staveley, Tupman, et al., 1955T = 284 to 329 K.; DH
27.99298.Kurbatov, 1948T = -52 to 51°C. Mean Cp, four temperatures.; DH
33.39303.6Phillip, 1939DH
27.01298.1Richards and Wallace, 1932T = 293 to 323 K.; DH
27.61293.2Williams and Daniels, 1925T = 20 to 50°C.; DH
27.89303.Willams and Daniels, 1924T = 295 to 315 K. Equation only.; DH

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
DRB - Donald R. Burgess, Jr.
AC - William E. Acree, Jr., James S. Chickos
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Tboil334.3 ± 0.2KAVGN/AAverage of 36 out of 37 values; Individual data points
Quantity Value Units Method Reference Comment
Tfus210. ± 2.KAVGN/AAverage of 14 values; Individual data points
Quantity Value Units Method Reference Comment
Ttriple209.61KN/AStull, 1937Uncertainty assigned by TRC = 0.2 K; TRC
Quantity Value Units Method Reference Comment
Tc537. ± 2.KAVGN/AAverage of 6 values; Individual data points
Quantity Value Units Method Reference Comment
Pc52.5900atmN/ACampbell and Chatterjee, 1969Uncertainty assigned by TRC = 0.09998 atm; TRC
Pc52.5900atmN/ACampbell and Chatterjee, 1968Uncertainty assigned by TRC = 0.0599 atm; TRC
Quantity Value Units Method Reference Comment
ρc4.11mol/lN/ACampbell and Chatterjee, 1969Uncertainty assigned by TRC = 0.03 mol/l; TRC
ρc3.84mol/lN/ACampbell and Chatterjee, 1968Uncertainty assigned by TRC = 0.02 mol/l; TRC
ρc4.15mol/lN/AHerz and Neukirch, 1923Uncertainty assigned by TRC = 0.02 mol/l; TRC
Quantity Value Units Method Reference Comment
Δvap7.50kcal/molN/AMajer and Svoboda, 1985 
Δvap7.49 ± 0.02kcal/molReviewManion, 2002weighted average of several measurements plus a correction for non-ideality; DRB
Δvap7.43kcal/molCMajer, Sváb, et al., 1980AC
Δvap7.30 ± 0.10kcal/molVMathews, 1926Reanalyzed by Pedley, Naylor, et al., 1986, Original value = 7.02 ± 0.05 kcal/mol; ALS

Enthalpy of vaporization

ΔvapH (kcal/mol) Temperature (K) Method Reference Comment
6.989334.3N/AMajer and Svoboda, 1985 
7.36321.N/AChen, Wang, et al., 1995Based on data from 306. to 427. K.; AC
7.60254.AStephenson and Malanowski, 1987Based on data from 227. to 269. K.; AC
7.27348.AStephenson and Malanowski, 1987Based on data from 333. to 416. K.; AC
6.91425.AStephenson and Malanowski, 1987Based on data from 410. to 481. K.; AC
7.19494.AStephenson and Malanowski, 1987Based on data from 479. to 523. K.; AC
7.77275.EBBoublík and Aim, 1972Based on data from 260. to 333. K.; AC
8.37230.N/AStull, 1947Based on data from 215. to 334. K.; AC
7.39320.N/AScatchard and Raymond, 1938Based on data from 308. to 333. K.; AC

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
215. to 334.44.202011233.129-40.953Stull, 1947Coefficents calculated by NIST from author's data.
334.4 to 527.4.564211486.455-8.612Stull, 1947Coefficents calculated by NIST from author's data.

Enthalpy of fusion

ΔfusH (kcal/mol) Temperature (K) Reference Comment
2.1209.6Acree, 1991AC

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, 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:
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 + Trichloromethane = (Chlorine anion • Trichloromethane)

By formula: Cl- + CHCl3 = (Cl- • CHCl3)

Quantity Value Units Method Reference Comment
Δr15.2 ± 2.0kcal/molTDAsYamdagni and Kebarle, 1971gas phase; B,M
Δr19.5 ± 2.0kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B
Δr18.10kcal/molMoblGiles and Grimsrud, 1993gas phase; B
Δr18.1 ± 2.0kcal/molIMRELarson and McMahon, 1984gas phase; B,M
Δr19.10 ± 0.70kcal/molTDEqDougherty, Dalton, et al., 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Δr23.2cal/mol*KN/ALarson and McMahon, 1984gas phase; From thermochemical cycle(Cl-)CF3H, Entropy change calculated or estimated; Larson and McMahon, 1984, 2; M
Δr24.5cal/mol*KHPMSDougherty, Dalton, et al., 1974gas phase; M
Δr14.8cal/mol*KPHPMSYamdagni and Kebarle, 1971gas phase; Entropy change is questionable; M
Quantity Value Units Method Reference Comment
Δr11. ± 1.kcal/molAVGN/AAverage of 6 values; Individual data points

CCl3- + Hydrogen cation = Trichloromethane

By formula: CCl3- + H+ = CHCl3

Quantity Value Units Method Reference Comment
Δr360.33kcal/molAcidPaulino and Squires, 1991gas phase; B
Δr357.6 ± 2.1kcal/molG+TSPaulino and Squires, 1991gas phase; B
Δr357.0 ± 6.1kcal/molG+TSBohme, Lee-Ruff, et al., 1972gas phase; > acetone, <= C5H6; value altered from reference due to change in acidity scale; B
Quantity Value Units Method Reference Comment
Δr349.9 ± 2.0kcal/molIMRBPaulino and Squires, 1991gas phase; B
Δr349.9 ± 3.0kcal/molIMRBBorn, Ingemann, et al., 2000gas phase; B
Δr349.3 ± 6.0kcal/molIMRBBohme, Lee-Ruff, et al., 1972gas phase; > acetone, <= C5H6; value altered from reference due to change in acidity scale; B

CN- + Trichloromethane = (CN- • Trichloromethane)

By formula: CN- + CHCl3 = (CN- • CHCl3)

Quantity Value Units Method Reference Comment
Δr18.2 ± 3.5kcal/molIMRELarson and McMahon, 1987gas phase; B,M
Quantity Value Units Method Reference Comment
Δr24.8cal/mol*KN/ALarson and McMahon, 1987gas phase; switching reaction,Thermochemical ladder(CN-)H2O, Entropy change calculated or estimated; Payzant, Yamdagni, et al., 1971; M
Quantity Value Units Method Reference Comment
Δr10.8 ± 2.3kcal/molIMRELarson and McMahon, 1987gas phase; B,M

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
Δr-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

Bromine anion + Trichloromethane = (Bromine anion • Trichloromethane)

By formula: Br- + CHCl3 = (Br- • CHCl3)

Quantity Value Units Method Reference Comment
Δr15.80kcal/molMoblGiles and Grimsrud, 1993gas phase; B
Quantity Value Units Method Reference Comment
Δr9.50kcal/molMoblGiles and Grimsrud, 1993gas phase; B

CHCl4- + 2Trichloromethane = C2H2Cl7-

By formula: CHCl4- + 2CHCl3 = C2H2Cl7-

Quantity Value Units Method Reference Comment
Δr14.70kcal/molN/AHiraoka, Mizuno, et al., 2001gas phase; B
Quantity Value Units Method Reference Comment
Δr7.25kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B

C2H2Cl7- + 3Trichloromethane = C3H3Cl10-

By formula: C2H2Cl7- + 3CHCl3 = C3H3Cl10-

Quantity Value Units Method Reference Comment
Δr11.80kcal/molN/AHiraoka, Mizuno, et al., 2001gas phase; B
Quantity Value Units Method Reference Comment
Δr5.24kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B

C4H9+ + Trichloromethane = (C4H9+ • Trichloromethane)

By formula: C4H9+ + CHCl3 = (C4H9+ • CHCl3)

Quantity Value Units Method Reference Comment
Δr9.1kcal/molPHPMSSharma, Meza de Hojer, et al., 1985gas phase; M
Quantity Value Units Method Reference Comment
Δr23.6cal/mol*KPHPMSSharma, Meza de Hojer, et al., 1985gas phase; M

Sodium hydroxide + Chloral = sodium formate + Trichloromethane

By formula: HNaO + C2HCl3O = CHNaO2 + CHCl3

Quantity Value Units Method Reference Comment
Δr-24.58kcal/molCmPritchard and Skinner, 1950liquid phase; Heat of hydrolysis; ALS

Trichloromethane + Chlorine = Carbon Tetrachloride + Hydrogen chloride

By formula: CHCl3 + Cl2 = CCl4 + HCl

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

Iodide + Trichloromethane = (Iodide • Trichloromethane)

By formula: I- + CHCl3 = (I- • CHCl3)

Quantity Value Units Method Reference Comment
Δr14.1 ± 1.0kcal/molTDAsCaldwell, Masucci, et al., 1989gas phase; B,M

Trichloromethane + Bromine = Hydrogen bromide + Methane, bromotrichloro-

By formula: CHCl3 + Br2 = HBr + CBrCl3

Quantity Value Units Method Reference Comment
Δr-1.4 ± 0.1kcal/molEqkMendenhall, Golden, et al., 1973gas phase; ALS

2Fluorodichloromethane = Trichloromethane + Difluorochloromethane

By formula: 2CHCl2F = CHCl3 + CHClF2

Quantity Value Units Method Reference Comment
Δr-3.39 ± 0.48kcal/molEqkHess and Kemnitz, 1992gas phase; Gas 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
Δr-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
Δr-71.96 ± 0.81kcal/molRSCCalado, Dias, et al., 1979MS

Hydrogen bromide + Methane, bromotrichloro- = Trichloromethane + Bromine

By formula: HBr + CBrCl3 = CHCl3 + Br2

Quantity Value Units Method Reference Comment
Δr1.4kcal/molKinSullivan and Davidson, 1951gas 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, 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: 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
0.254500.LN/A 
0.274100.MN/A 
0.233800.MN/A 
0.25 MN/A 
0.263900.MN/A 
0.264000.XN/A 
0.24 QN/A missing citation give several references for the Henry's law constants but don't assign them to specific species.
0.497300.MN/A 
0.242200.XN/A 
0.235000.XN/A 
0.254100.XBarr and Newsham, 1987 
0.284600.MGossett, 1987 
0.264300.XN/A 
0.234200.XN/A 
0.254300.XN/A 
0.244200.MN/A 
0.33 MNicholson, Maguire, et al., 1984 
0.28 cNicholson, Maguire, et al., 1984 
0.32 CNicholson, Maguire, et al., 1984 
0.21 CNicholson, Maguire, et al., 1984 
0.203900.MN/ASolubility in sea water.
0.304400.XN/A 
0.254100.XLeighton and Calo, 1981 
0.27 LN/A 
0.155600.XN/A 
0.254600.XN/A 
0.25 VN/A 
0.90 VN/AValue at T = 275. K.
0.31 CN/A 
0.23 VN/A 
0.35 MPearson and McConnell, 1975The same data was also published in missing citation. Value at T = 293. K.
0.294800.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, 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 evaluated as indicated in comments:
L - Sharon G. Lias

Data compiled as indicated in comments:
B - John E. Bartmess
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

Quantity Value Units Method Reference Comment
IE (evaluated)11.37 ± 0.02eVN/AN/AL

Electron affinity determinations

EA (eV) Method Reference Comment
0.62 ± 0.16IMRBStaneke, Groothuis, et al., 1995EA > EA(CH2S-.), and Cl-A(CHCl2.) < Cl-A(CHCl3). May be ion-molecule complex.; B
1.756 ± 0.052SIGaines, Kay, et al., 1966The Magnetron method, lacking mass analysis, is not considered reliable.; B

Ionization energy determinations

IE (eV) Method Reference Comment
11.41 ± 0.02PIWang and Leroi, 1983LBLHLM
11.3PEVon Niessen, Asbrink, et al., 1982LBLHLM
11.48PEKimura, Katsumata, et al., 1981LLK
11.37 ± 0.02PIWerner, Tsai, et al., 1974LLK
11.40PEDewar and Worley, 1969RDSH
11.50CICermak, 1968RDSH
11.42 ± 0.03PIWatanabe, 1957RDSH
11.5PEVon Niessen, Asbrink, et al., 1982Vertical value; LBLHLM
11.48PEDixon, Murrell, et al., 1971Vertical value; LLK

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
C+24.62?EIReed and Snedden, 1956RDSH
CCl+16.3 ± 0.2?EIHobrock and Kiser, 1964RDSH
CCl2+12.2?EIShapiro and Lossing, 1968RDSH
CCl3+11.70 ± 0.09HEIMartin, Lampe, et al., 1966RDSH
CH+16.8 ± 1.0Cl2+ClEIOgawa, Miyoshi, et al., 1982LBLHLM
CH+23.9 ± 0.3?EIHobrock and Kiser, 1964RDSH
CHCl+17.5 ± 0.2?EIHobrock and Kiser, 1964RDSH
CHCl2+11.52ClEIHolmes, Lossing, et al., 1988LL
CHCl2+11.49 ± 0.02ClPIWerner, Tsai, et al., 1974LLK
CHCl2+11.52ClEILossing, 1972LLK
CHCl2+11.64 ± 0.20ClEIHobrock and Kiser, 1964RDSH
CHCl2+11.7 ± 0.1ClEIHarrison and Shannon, 1962RDSH
CHCl2+12.43 ± 0.02ClEIReed and Snedden, 1956RDSH
Cl+22.0 ± 0.3?EIHobrock and Kiser, 1964RDSH
H+20.5 ± 1.74H+CCl3EIOgawa, Miyoshi, et al., 1982LBLHLM

De-protonation reactions

CCl3- + Hydrogen cation = Trichloromethane

By formula: CCl3- + H+ = CHCl3

Quantity Value Units Method Reference Comment
Δr360.33kcal/molAcidPaulino and Squires, 1991gas phase; B
Δr357.6 ± 2.1kcal/molG+TSPaulino and Squires, 1991gas phase; B
Δr357.0 ± 6.1kcal/molG+TSBohme, Lee-Ruff, et al., 1972gas phase; > acetone, <= C5H6; value altered from reference due to change in acidity scale; B
Quantity Value Units Method Reference Comment
Δr349.9 ± 2.0kcal/molIMRBPaulino and Squires, 1991gas phase; B
Δr349.9 ± 3.0kcal/molIMRBBorn, Ingemann, et al., 2000gas phase; B
Δr349.3 ± 6.0kcal/molIMRBBohme, Lee-Ruff, et al., 1972gas phase; > acetone, <= C5H6; value altered from reference due to change in acidity scale; B

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, 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:
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

Bromine anion + Trichloromethane = (Bromine anion • Trichloromethane)

By formula: Br- + CHCl3 = (Br- • CHCl3)

Quantity Value Units Method Reference Comment
Δr15.80kcal/molMoblGiles and Grimsrud, 1993gas phase; B
Quantity Value Units Method Reference Comment
Δr9.50kcal/molMoblGiles and Grimsrud, 1993gas phase; B

CHCl4- + 2Trichloromethane = C2H2Cl7-

By formula: CHCl4- + 2CHCl3 = C2H2Cl7-

Quantity Value Units Method Reference Comment
Δr14.70kcal/molN/AHiraoka, Mizuno, et al., 2001gas phase; B
Quantity Value Units Method Reference Comment
Δr7.25kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B

CN- + Trichloromethane = (CN- • Trichloromethane)

By formula: CN- + CHCl3 = (CN- • CHCl3)

Quantity Value Units Method Reference Comment
Δr18.2 ± 3.5kcal/molIMRELarson and McMahon, 1987gas phase; B,M
Quantity Value Units Method Reference Comment
Δr24.8cal/mol*KN/ALarson and McMahon, 1987gas phase; switching reaction,Thermochemical ladder(CN-)H2O, Entropy change calculated or estimated; Payzant, Yamdagni, et al., 1971; M
Quantity Value Units Method Reference Comment
Δr10.8 ± 2.3kcal/molIMRELarson and McMahon, 1987gas phase; B,M

C2H2Cl7- + 3Trichloromethane = C3H3Cl10-

By formula: C2H2Cl7- + 3CHCl3 = C3H3Cl10-

Quantity Value Units Method Reference Comment
Δr11.80kcal/molN/AHiraoka, Mizuno, et al., 2001gas phase; B
Quantity Value Units Method Reference Comment
Δr5.24kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B

C4H9+ + Trichloromethane = (C4H9+ • Trichloromethane)

By formula: C4H9+ + CHCl3 = (C4H9+ • CHCl3)

Quantity Value Units Method Reference Comment
Δr9.1kcal/molPHPMSSharma, Meza de Hojer, et al., 1985gas phase; M
Quantity Value Units Method Reference Comment
Δr23.6cal/mol*KPHPMSSharma, Meza de Hojer, et al., 1985gas phase; M

Chlorine anion + Trichloromethane = (Chlorine anion • Trichloromethane)

By formula: Cl- + CHCl3 = (Cl- • CHCl3)

Quantity Value Units Method Reference Comment
Δr15.2 ± 2.0kcal/molTDAsYamdagni and Kebarle, 1971gas phase; B,M
Δr19.5 ± 2.0kcal/molTDAsHiraoka, Mizuno, et al., 2001gas phase; B
Δr18.10kcal/molMoblGiles and Grimsrud, 1993gas phase; B
Δr18.1 ± 2.0kcal/molIMRELarson and McMahon, 1984gas phase; B,M
Δr19.10 ± 0.70kcal/molTDEqDougherty, Dalton, et al., 1974gas phase; B,M
Quantity Value Units Method Reference Comment
Δr23.2cal/mol*KN/ALarson and McMahon, 1984gas phase; From thermochemical cycle(Cl-)CF3H, Entropy change calculated or estimated; Larson and McMahon, 1984, 2; M
Δr24.5cal/mol*KHPMSDougherty, Dalton, et al., 1974gas phase; M
Δr14.8cal/mol*KPHPMSYamdagni and Kebarle, 1971gas phase; Entropy change is questionable; M
Quantity Value Units Method Reference Comment
Δr11. ± 1.kcal/molAVGN/AAverage of 6 values; Individual data points

Iodide + Trichloromethane = (Iodide • Trichloromethane)

By formula: I- + CHCl3 = (I- • CHCl3)

Quantity Value Units Method Reference Comment
Δr14.1 ± 1.0kcal/molTDAsCaldwell, Masucci, et al., 1989gas phase; B,M

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, Gas Chromatography, 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, 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

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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 291570

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), 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: Takehiko Shimanouchi

Symmetry:   C     Symmetry Number σ = 3


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

a1 1 CH str 3034  B 3034.1 M gas 3030 W gas
a1 2 CCl3 s-str 680  B 680 S gas 672 S gas
a1 3 CCl3 s-deform 363  C 366 liq. 363 M gas
e 4 CH bend 1220  B 1219.7 VS gas 1217 W gas
e 5 CCl3 d-str 774  B 774.0 VS gas 760 W gas
e 6 CCl3 d-deform 261  B 260 liq. 261 W gas

Source: Shimanouchi, 1972

Notes

VSVery strong
SStrong
MMedium
WWeak
B1~3 cm-1 uncertainty
C3~6 cm-1 uncertainty

Gas Chromatography

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, 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

View large format table.

Column type Active phase Temperature (C) I Reference Comment
CapillaryHP-10.617.2Wang, Liu, et al., 200530. m/0.25 mm/0.25 μm
CapillaryHP-110.619.Wang, Liu, et al., 200530. m/0.25 mm/0.25 μm
CapillaryHP-120.628.4Wang, Liu, et al., 200530. m/0.25 mm/0.25 μm
CapillaryHP-130.625.8Wang, Liu, et al., 200530. m/0.25 mm/0.25 μm
CapillaryHP-140.621.1Wang, Liu, et al., 200530. m/0.25 mm/0.25 μm
CapillaryHP-150.618.2Wang, Liu, et al., 200530. m/0.25 mm/0.25 μm
CapillaryHP-160.614.8Wang, Liu, et al., 200530. m/0.25 mm/0.25 μm
PackedC78, Branched paraffin130.607.9Dallos, Sisak, et al., 2000He; Column length: 3.3 m
CapillaryOV-170.604.Annino and Villalobos, 199922.6 m/0.53 mm/2.78 μm
CapillaryDB-160.606.Dewulf, Van Langenhove, et al., 199730. m/0.53 mm/5.0 μm, He
CapillaryOV-150.604.Villalobos, 199530. m/0.32 mm/0.96 μm
PackedC78, Branched paraffin130.606.8Reddy, Dutoit, et al., 1992Chromosorb G HP; Column length: 3.3 m
PackedApolane130.610.Dutoit, 1991Column length: 3.7 m
PackedOV-1100.604.Castello and Gerbino, 1988He, Chromosorb W DMCS; Column length: 3. m
PackedOV-1125.608.Castello and Gerbino, 1988He, Chromosorb W DMCS; Column length: 3. m
PackedOV-175.602.Castello and Gerbino, 1988He, Chromosorb W DMCS; Column length: 3. m
PackedSqualane80.582.Pacáková, Vojtechová, et al., 1988N2, Chezasorb AW-HMDS; Column length: 1.2 m
PackedSE-30100.609.Winskowski, 1983Gaschrom Q; Column length: 2. m
PackedPorapack Q200.568.Goebel, 1982N2
PackedApolane70.595.2Riedo, Fritz, et al., 1976He, Chromosorb; Column length: 2.4 m
PackedApiezon L100.616.Brown, Chapman, et al., 1968N2, DCMS-treated Chromosorb W; Column length: 2.3 m
PackedDC-200100.610.Rohrschneider, 1966Column length: 4. m
PackedSqualane100.587.Rohrschneider, 1966Column length: 5. m
PackedApiezon L100.622.Rohrschneider, 1966Column length: 5. m
PackedApiezon L130.622.von Kováts, 1958Celite (40:60 Gewichtsverhaltnis)
PackedApiezon L70.613.von Kováts, 1958Celite (40:60 Gewichtsverhaltnis)

Kovats' RI, non-polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryCBP-1598.Shimadzu, 200325. m/0.2 mm/0.25 μm, He, 50. C @ 5. min, 4. K/min; Tend: 200. C
CapillaryDB-1601.Takeoka, Flath, et al., 199060. m/0.32 mm/0.25 μm, He, 30. C @ 4. min, 2. K/min; Tend: 210. C
CapillarySE-54616.Rembold, Wallner, et al., 198930. m/0.25 mm/0.25 μm, He, 0. C @ 12. min, 12. K/min; Tend: 250. C

Kovats' RI, polar column, isothermal

View large format table.

Column type Active phase Temperature (C) I Reference Comment
CapillaryCarbowax 20M70.1037.Annino and Villalobos, 199931.3 m/0.53 mm/0.54 μm
CapillaryCarbowax 20M50.1037.Villalobos, 199530. m/0.32 mm/0.54 μm, He
CapillarySupelcowax-1060.1034.Castello, Vezzani, et al., 1991N2; Column length: 60. m; Column diameter: 0.75 mm
PackedSP-1000100.1030.11Castello and Gerbino, 1988He, Chromosorb W DMCS; Column length: 3. m
PackedSP-1000125.1028.95Castello and Gerbino, 1988He, Chromosorb W DMCS; Column length: 3. m
PackedSP-100075.1027.69Castello and Gerbino, 1988He, Chromosorb W DMCS; Column length: 3. m
PackedCarbowax 20M75.1026.Goebel, 1982N2, Kieselgur (60-100 mesh); Column length: 2. m
PackedCarbowax 20M100.1026.Rohrschneider, 1966Column length: 2. m

Kovats' RI, polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryCBP-201024.Shimadzu, 200325. m/0.2 mm/0.25 μm, He, 50. C @ 5. min, 4. K/min; Tend: 200. C

Van Den Dool and Kratz RI, non-polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryHP-5615.Isidorov, Vinogorova, et al., 200325. C @ 5. min, 3. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tend: 150. C
CapillaryDB-1601.Helmig, Pollock, et al., 199630. m/0.25 mm/1. μm, 6. K/min; Tstart: -50. C; Tend: 180. C
CapillaryDB-5621.7Helmig, Pollock, et al., 199660. m/0.33 mm/0.25 μm, 6. K/min; Tstart: -50. C; Tend: 180. C
CapillaryPetrocol DH601.White, Hackett, et al., 1992100. m/0.25 mm/0.5 μm, He, 1. K/min; Tstart: 30. C; Tend: 220. C
CapillaryOV-101590.Misharina, Aerove, et al., 199150. m/0.32 mm/0.50 μm, He, 2. K/min; Tstart: 50. C; Tend: 250. C
CapillarySE-54618.Weber, 198625. m/0.31 mm/0.17 μm, H2, 2. K/min; Tstart: 35. C

Van Den Dool and Kratz RI, polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryDB-Wax1021.Fernandez-Segovia, Escriche, et al., 200630. m/0.25 mm/0.25 μm, He, 50. C @ 5. min, 10. K/min, 230. C @ 25. min
CapillaryCP-Wax 52CB1020.Alasalvar, Taylor, et al., 200560. m/0.25 mm/0.25 μm, 35. C @ 4. min, 3. K/min; Tend: 203. C
CapillarySupelcowax-101022.Elmore, Nisyrios, et al., 200560. m/0.25 mm/0.25 μm, He, 40. C @ 2. min, 4. K/min; Tend: 280. C
CapillarySupelcowax-101026.Chung, Yung, et al., 200260. m/0.25 mm/0.25 μm, He, 35. C @ 5. min, 2. K/min, 195. C @ 90. min
CapillarySupelcowax-101026.Chung, Yung, et al., 200160. m/0.25 mm/0.25 μm, He, 35. C @ 5. min, 2. K/min, 195. C @ 90. min
CapillaryDB-Wax1013.Cha, Kim, et al., 199860. m/0.25 mm/0.25 μm, 40. C @ 5. min, 3. K/min, 200. C @ 60. min
CapillaryFFAP1028.Ott, Fay, et al., 199730. m/0.25 mm/0.25 μm, He, 20. C @ 1. min, 4. K/min, 200. C @ 1. min
CapillaryDB-Wax1010.Shimoda, Peralta, et al., 199660. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 50. C; Tend: 230. C
CapillaryDB-Wax1020.Shimoda, Wu, et al., 199660. m/0.25 mm/0.25 μm, He, 3. K/min; Tstart: 50. C; Tend: 230. C
CapillaryDB-Wax1021.Iwaoka, Hagi, et al., 1994He, 40. C @ 5. min, 2. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tend: 200. C
CapillaryDB-Wax1022.Sumitani, Suekane, et al., 1994He, 40. C @ 5. min, 3. K/min; Column length: 60. m; Column diameter: 0.25 mm; Tend: 200. C
CapillarySupelcowax-101022.Chung and Cadwallader, 199360. m/0.25 mm/0.25 μm, He, 40. C @ 5. min, 2. K/min, 195. C @ 40. min

Van Den Dool and Kratz RI, polar column, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillarySupelcowax-101018.Bianchi, Careri, et al., 200730. m/0.25 mm/0.25 μm, He; Program: 35C(8min) => 4C/min => 60C => 6C/min => 160C => 20C/min => 200C(1min)
CapillarySupelcowax-101020.Bianchi, Careri, et al., 200730. m/0.25 mm/0.25 μm, He; Program: 35C(8min) => 4C/min => 60C => 6C/min => 160C => 20C/min => 200C(1min)
CapillarySupelcowax-101023.Bianchi, Careri, et al., 200730. m/0.25 mm/0.25 μm, He; Program: 35C(8min) => 4C/min => 60C => 6C/min => 160C => 20C/min => 200C(1min)
CapillaryCP-Wax 52CB1022.Verzera, Ziino, et al., 200460. m/0.25 mm/0.25 μm, He; Program: 45C(5min) => 10C/min => 80C => 2C/min => 240C
CapillaryInnowax999.Larráyoz, Addis, et al., 200160. m/0.22 mm/0.25 μm, He; Program: 35C (1min) => 3C/min => 170C => 4C/min => 200C (20min)
CapillaryDB-Wax1038.Radovic, Careri, et al., 200130. m/0.25 mm/0.25 μm; Program: 30C(8min) => 4C/min => 60C => 6C/min => 160C => 20C/min => 200C(1min)

Normal alkane RI, non-polar column, isothermal

View large format table.

Column type Active phase Temperature (C) I Reference Comment
CapillaryDB-160.600.Shimadzu, 2003, 260. m/0.32 mm/1. μm, He
PackedSynachrom150.561.Dufka, Malinsky, et al., 1971Helium, Synachrom (60-80 mesh); Column length: 1.5 m
PackedSynachrom150.569.Dufka, Malinsky, et al., 1971Helium, Synachrom (60-80 mesh); Column length: 1.5 m
PackedDC-400150.630.Anderson, 1968Helium, Gas-Pak (60-80 mesh); Column length: 3.0 m

Normal alkane RI, non-polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
PackedSE-30605.MHA, 9999Nitrogen, Chromosorb G AW DMCS (80-100 mesh); Column length: 2. m; Tstart: 100. C; Tend: 300. C
CapillaryHP-5 MS615.Kotowska, Zalikowski, et al., 201230. m/0.25 mm/0.25 μm, Helium, 35. C @ 5. min, 3. K/min, 300. C @ 15. min
CapillaryPetrocol DH601.Supelco, 2012100. m/0.25 mm/0.50 μm, Helium, 20. C @ 15. min, 15. K/min, 220. C @ 30. min
CapillaryHP-5 MS615.Kim and Chung, 200930. m/0.25 mm/0.25 μm, Helium, 35. C @ 5. min, 2. K/min, 195. C @ 30. min
CapillarySPB-5618.Vasta, Ratel, et al., 200760. m/0.32 mm/1. μm, 40. C @ 5. min, 3. K/min, 230. C @ 5. min
CapillaryHP-5618.Isidorov and Jdanova, 20023. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 200. C
CapillaryBP-1600.Health Safety Executive, 200050. m/0.22 mm/0.75 μm, He, 5. K/min; Tstart: 50. C; Tend: 200. C
CapillarySE-54588.Huang, Liang, et al., 199636. m/0.25 mm/0.25 μm, 5. K/min; Tstart: 35. C; Tend: 240. C
CapillaryDB-1601.Habu, Flath, et al., 19853. K/min; Column length: 50. m; Column diameter: 0.32 mm; Tstart: 0. C; Tend: 250. C

Normal alkane RI, non-polar column, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillaryHP-5 MS616.Kotowska, Zalikowski, et al., 201230. m/0.25 mm/0.25 μm, Helium; Program: not specified
CapillaryHP-5609.Pugliese, Sirtori, et al., 200950. m/0.32 mm/1.05 μm, Helium; Program: not specified
CapillaryHP-5617.Rotsatschakul, Visesanguan, et al., 200960. m/0.25 mm/0.25 μm, Helium; Program: 30 0C (2 min) 2 0Cmin -> 60 0C 10 0C/min -> 100 0C 20 0C/min -> 140 0C 10 0C/min -> 200 0C (10 min)
CapillaryPolydimethyl siloxanes609.Zenkevich, Eliseenkov, et al., 2006Program: not specified
CapillaryMethyl Silicone609.Zenkevich, 2001Program: not specified
CapillaryMethyl Silicone611.Zenkevich, 2001Program: not specified
CapillaryHP-5629.Timón, Ventanas, et al., 199850. m/0.32 mm/0.52 μm, He; Program: 35 0C 10 0C/min -> 200 0C (20 min) 5 0C/min -> 230 0C (50 min)
CapillaryMethyl Silicone609.Zenkevich, 1998Program: not specified
CapillarySPB-1603.Flanagan, Streete, et al., 199760. m/0.53 mm/5. μm, He; Program: 40C(6min) => 5C/min => 80C => 10C/min => 200C
CapillaryDB-5620.Mateo and Zumalacárregui, 199650. m/0.32 mm/0.25 μm, He; Program: 40C (10min) => 3C/min => 95C => 10C/min => 270C (10min)
CapillaryDB-5618.Sorimachi, Tanabe, et al., 1995He; Column length: 30. m; Program: not specified
CapillaryMethyl Silicone609.Zenkevich, Korolenko, et al., 1995Program: not specified
CapillaryDB-1601.Ciccioli, Cecinato, et al., 199460. m/0.32 mm/0.25 μm; Program: not specified
CapillaryDB-1601.Ciccioli, Brancaleoni, et al., 199360. m/0.32 mm/0.25 μm; Program: 3 min at 5 C; 5 - 50 C at 3 deg/min; 50 - 220 C at 5 deg/min
CapillarySPB-1603.Strete, Ruprah, et al., 199260. m/0.53 mm/5.0 μm, Helium; Program: 40 0C (6 min) 5 0C/min -> 80 0C 10 0C/min -> 200 0C
CapillarySPB-1605.Strete, Ruprah, et al., 199260. m/0.53 mm/5.0 μm, Helium; Program: not specified
CapillaryCP Sil 8 CB620.Weller and Wolf, 198940. m/0.25 mm/0.25 μm, He; Program: 30 0C (1 min) 15 0C/min -> 45 0C 3 0C/min -> 120 0C
Capillarymethyl silicone oil with 5% Igepal609.Schultz, Flath, et al., 1988Column length: 150. m; Column diameter: 0.75 mm; Program: not specified
Capillarymethyl silicone oil with 5% Igepal611.Schultz, Flath, et al., 1988Column length: 150. m; Column diameter: 0.75 mm; Program: not specified
CapillaryDB-1601.Takeoka, Flath, et al., 198830. m/0.25 mm/0.25 μm, H2; Program: 30C (2min) => 2C/min => 150C => 4C/min => 250C
CapillaryDB-1606.Takeoka, Flath, et al., 198830. m/0.25 mm/0.25 μm, H2; Program: 30C (2min) => 2C/min => 150C => 4C/min => 250C
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.603.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.609.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.616.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryOV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.595.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryOV-1605.Ramsey and Flanagan, 1982Program: not specified
CapillarySE-30605.Heydanek and McGorrin, 1981He; Column length: 50. m; Column diameter: 0.5 mm; Program: -10C (8min) => 12C/min => 26C => 3C/min => 170C (30min)

Normal alkane RI, polar column, isothermal

View large format table.

Column type Active phase Temperature (C) I Reference Comment
CapillaryDB-Wax60.1010.Shimadzu, 2003, 250. m/0.32 mm/1. μm, He
CapillaryDB-Wax60.1045.Shimadzu, 2003, 250. m/0.32 mm/1. μm, He

Normal alkane RI, polar column, temperature ramp

View large format table.

Column type Active phase I Reference Comment
CapillaryHP-Innowax1007.Puvipirom and Chaisei, 201215. m/0.32 mm/0.50 μm, Helium, 3. K/min; Tstart: 40. C; Tend: 250. C
CapillaryDB-Wax1037.Shimadzu, 201230. m/0.32 mm/0.50 μm, Helium, 4. K/min; Tstart: 40. C; Tend: 260. C
CapillaryDB-Wax1037.Shimadzu Corporation, 200330. m/0.32 mm/0.5 μm, He, 4. K/min; Tstart: 40. C; Tend: 260. C
CapillaryDB-Wax1017.Duque, Bonilla, et al., 200130. m/0.25 mm/0.25 μm, Helium, 4. K/min, 220. C @ 30. min; Tstart: 25. C
CapillaryDB-Wax1025.Kobayashi, Tsuda, et al., 1995He, 60. C @ 4. min, 2. K/min; Column length: 60. m; Column diameter: 0.25 mm; Tend: 180. C
CapillaryDB-Wax1015.Takeoka and Butter, 198960. m/0.32 mm/0.25 μm, He, 30. C @ 4. min, 2. K/min; Tend: 180. C
CapillaryDB-Wax1016.Takeoka and Butter, 198960. m/0.32 mm/0.25 μm, He, 30. C @ 4. min, 2. K/min; Tend: 180. C

Normal alkane RI, polar column, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillarySupelcowax-101037.Soria, Martinez-Castro, et al., 200950. m/0.25 mm/0.25 μm, Helium; Program: 45 0C (15 min) 3 0C/min -> 75 0C 5 0C/min -> 180 0C (10 min)
CapillarySupelcowax 101037.Soria, Martinez-Castro, et al., 200850. m/0.25 mm/0.25 μm, Helium; Program: 45 0C (15 min) 3 0C/min -> 75 0C 5 0C/min -> 180 0C (10 min)
CapillarySupelcowax-101018.Berard, Bianchi, et al., 200730. m/0.25 mm/0.25 μm, He; Program: 35C(8min) => 6C/min => 60C => 4C/min => 160C => 20C/min => 200C(1min)
CapillarySupelcowax-101020.Berard, Bianchi, et al., 200730. m/0.25 mm/0.25 μm, He; Program: 35C(8min) => 6C/min => 60C => 4C/min => 160C => 20C/min => 200C(1min)
CapillaryBP-20992.Pontes, Marques, et al., 200730. m/0.25 mm/0.25 μm, He; Program: 50C(1min) => 2.5C/min => 100C => 2C/min => 180C => 15C/min => 220C
CapillaryDB-Wax1014.le Pape, Grua-Priol, et al., 200430. m/0.32 mm/0.5 μm, He; Program: 40C => 1C/min => 57C => 15C/min => 230C (5min)
CapillaryPolyethylene Glycol1014.Zenkevich, Korolenko, et al., 1995Program: not specified
CapillarySuperox 0.6; Carbowax 20M1000.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryCarbowax 400, Carbowax 20M, Carbowax 1540, Carbowax 4000, Superox 06, PEG 20M, etc.1000.Waggott and Davies, 1984Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
CapillaryCarbowax 20M1024.Ramsey and Flanagan, 1982Program: not specified

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, Gas Chromatography, Notes

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

Chase, 1998
Chase, M.W., Jr., NIST-JANAF Themochemical Tables, Fourth Edition, J. Phys. Chem. Ref. Data, Monograph 9, 1998, 1-1951. [all data]

Manion, 2002
Manion, J.A., Evaluated Enthalpies of Formation of the Stable Closed Shell C1 and C2 Chlorinated Hydrocarbons, J. Phys. Chem. Ref. Data, 2002, 31, 1, 123-172, https://doi.org/10.1063/1.1420703 . [all data]

Hu and Sinke, 1969
Hu, A.T.; Sinke, G.C., Combustion calorimetry of some chlorinated organic compounds, J. Chem. Thermodyn., 1969, 1, 6, 507, https://doi.org/10.1016/0021-9614(69)90010-X . [all data]

Hu and Sinke, 1969, 2
Hu, A.T.; Sinke, G.C., Combustion calorimetry of some chlorinated organic compounds, J. Chem. Thermodyn., 1969, 1, 507-513. [all data]

Smith, Bjellerup, et al., 1953
Smith, L.; Bjellerup, L.; Krook, S.; Westermark, H., Heats of combustion of organic chloro compounds determined by the "quartz wool" method, Acta Chem. Scand., 1953, 7, 65. [all data]

Cox and Pilcher, 1970
Cox, J.D.; Pilcher, G., Thermochemistry of Organic and Organometallic Compounds, Academic Press, New York, 1970, 1-636. [all data]

Grolier, Roux-Desgranges, et al., 1993
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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, Gas Chromatography, References