Dimethyl Sulfoxide

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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, 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: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Δfgas-35.97 ± 0.36kcal/molCcrMasuda, Nagano, et al., 1994H2SO4 (1:115 H2O)

Condensed phase thermochemistry data

Go To: Top, Gas phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law 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 as indicated in comments:
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-48.61 ± 0.33kcal/molCcrMasuda, Nagano, et al., 1994H2SO4 (1:115 H2O); ALS
Quantity Value Units Method Reference Comment
Δcliquid-486.93 ± 0.30kcal/molCcrMasuda, Nagano, et al., 1994H2SO4 (1:115 H2O); ALS
Quantity Value Units Method Reference Comment
liquid45.120cal/mol*KN/AClever and Westrum, 1970DH

Constant pressure heat capacity of liquid

Cp,liquid (cal/mol*K) Temperature (K) Reference Comment
35.705298.15Grolier, Roux-Desgranges, et al., 1993DH
35.440298.15Barta, Kooner, et al., 1989DH
36.71298.15Rodante and Marrosu, 1988DH
36.62298.15Lankford and Criss, 1987DH
37.26298.15de Visser and Somsen, 1979DH
37.26298.15De Visser, Heuvelsland, et al., 1978DH
36.611298.15Clever and Westrum, 1970T = 5 to 350 K.; DH
35.61298.15Kenttmaa and Lindberg, 1960T = 298, 343 K.; DH

Phase change data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Reaction thermochemistry data, Henry's Law 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 as indicated in comments:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Tboil463. ± 1.KAVGN/AAverage of 6 values; Individual data points
Quantity Value Units Method Reference Comment
Tfus291.65KN/ALindberg and Stenholm, 1966Uncertainty assigned by TRC = 0.4 K; TRC
Tfus291.57KN/ADouglas, 1948Uncertainty assigned by TRC = 0.2 K; TRC
Tfus291.65KN/ADouglas, 1946Uncertainty assigned by TRC = 0.2 K; TRC
Quantity Value Units Method Reference Comment
Ttriple291.59KN/AClever and Westrum, 1970, 2Uncertainty assigned by TRC = 0.1 K; TRC
Ttriple291.67KN/AClever and Westrum, 1970, 2Uncertainty assigned by TRC = 0.06 K; TRC
Quantity Value Units Method Reference Comment
Δvap12.6 ± 0.1kcal/molVDouglas, 1948, 2ALS
Δvap12.6 ± 0.1kcal/molRGDouglas, 1948, 3Based on data from 293. to 323. K.; AC

Enthalpy of vaporization

ΔvapH (kcal/mol) Temperature (K) Method Reference Comment
11.5368.TGAAl-Najjar and Al-Sammerrai, 2007Based on data from 353. to 383. K.; AC
11.6392.N/ADykyj, Svoboda, et al., 1999Based on data from 377. to 483. K.; AC
12.4320.AStephenson and Malanowski, 1987Based on data from 305. to 464. K.; AC
12.5308.N/ASassa, Konishi, et al., 1974Based on data from 298. to 318. K.; AC
12.1340.MMJakli and Alexander Van Hook, 1972Based on data from 325. to 442. K. See also Boublik, Fried, et al., 1984.; AC
12.5318.N/ANISHIMURA, NAKAYAMA, et al., 1972Based on data from 303. to 423. K.; AC
12.5308.N/AMeszaros, 1969Based on data from 293. to 323. 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
325.49 to 442.094.485361807.002-60.995Jakli and van Hook, 1972Coefficents calculated by NIST from author's data.
293. to 323.5.224682239.161-29.215Douglas, 1948, 3Coefficents calculated by NIST from author's data.

Enthalpy of fusion

ΔfusH (kcal/mol) Temperature (K) Reference Comment
3.4340291.67Clever and Westrum, 1970DH
3.435291.7Domalski and Hearing, 1996AC

Entropy of fusion

ΔfusS (cal/mol*K) Temperature (K) Reference Comment
11.77291.67Clever and Westrum, 1970DH

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, 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 as indicated in comments:
B - John E. Bartmess
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias
RCD - Robert C. Dunbar
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

C2H5OS- + Hydrogen cation = Dimethyl Sulfoxide

By formula: C2H5OS- + H+ = C2H6OS

Quantity Value Units Method Reference Comment
Δr373.5 ± 2.1kcal/molG+TSBartmess, Scott, et al., 1979gas phase; value altered from reference due to change in acidity scale; B
Δr374.3 ± 2.3kcal/molG+TSCumming and Kebarle, 1978gas phase; B
Quantity Value Units Method Reference Comment
Δr366.4 ± 2.0kcal/molIMREBartmess, Scott, et al., 1979gas phase; value altered from reference due to change in acidity scale; B
Δr367.2 ± 2.0kcal/molIMRECumming and Kebarle, 1978gas phase; B

Nitrogen oxide anion + Dimethyl Sulfoxide = (Nitrogen oxide anion • Dimethyl Sulfoxide)

By formula: NO2- + C2H6OS = (NO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr19.2 ± 1.0kcal/molTDAsSieck, 1985gas phase; B,M
Quantity Value Units Method Reference Comment
Δr25.cal/mol*KN/ASieck, 1985gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
Δr8.7 ± 1.0kcal/molTDAsSieck, 1985gas phase; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
8.7420.PHPMSSieck, 1985gas phase; Entropy change calculated or estimated; M

C6H5NO2- + Dimethyl Sulfoxide = (C6H5NO2- • Dimethyl Sulfoxide)

By formula: C6H5NO2- + C2H6OS = (C6H5NO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr16.80 ± 0.10kcal/molTDAsSieck, 1985gas phase; B,M
Quantity Value Units Method Reference Comment
Δr24.5cal/mol*KPHPMSSieck, 1985gas phase; M
Quantity Value Units Method Reference Comment
Δr9.50 ± 0.20kcal/molTDAsSieck, 1985gas phase; B
Δr8.6 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

C7H7NO3- + Dimethyl Sulfoxide = (C7H7NO3- • Dimethyl Sulfoxide)

By formula: C7H7NO3- + C2H6OS = (C7H7NO3- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr16.3 ± 2.0kcal/molN/AChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B,M
Quantity Value Units Method Reference Comment
Δr22.5cal/mol*KPHPMSChowdhury, 1987gas phase; M
Quantity Value Units Method Reference Comment
Δr8.4 ± 2.0kcal/molTDAsChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Bromine anion + Dimethyl Sulfoxide = (Bromine anion • Dimethyl Sulfoxide)

By formula: Br- + C2H6OS = (Br- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr17.30kcal/molTDAsMagnera, Caldwell, et al., 1984gas phase; B,M
Δr17.2kcal/molHPMSCaldwell, Masucci, et al., 1989gas phase; M
Quantity Value Units Method Reference Comment
Δr21.4cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr10.90kcal/molTDAsMagnera, Caldwell, et al., 1984gas phase; B

Iodide + Dimethyl Sulfoxide = (Iodide • Dimethyl Sulfoxide)

By formula: I- + C2H6OS = (I- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr15.70kcal/molTDAsMagnera, Caldwell, et al., 1984gas phase; B,M
Δr16.kcal/molPHPMSCaldwell, Masucci, et al., 1989gas phase; M
Quantity Value Units Method Reference Comment
Δr21.7cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr9.20kcal/molTDAsMagnera, Caldwell, et al., 1984gas phase; B

C7H4F3NO2- + Dimethyl Sulfoxide = (C7H4F3NO2- • Dimethyl Sulfoxide)

By formula: C7H4F3NO2- + C2H6OS = (C7H4F3NO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr14.6 ± 2.0kcal/molN/AChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B,M
Quantity Value Units Method Reference Comment
Δr22.3cal/mol*KPHPMSChowdhury, 1987gas phase; M
Quantity Value Units Method Reference Comment
Δr7.1 ± 2.0kcal/molTDAsChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Chlorine anion + Dimethyl Sulfoxide = (Chlorine anion • Dimethyl Sulfoxide)

By formula: Cl- + C2H6OS = (Cl- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr18.60kcal/molTDAsMagnera, Caldwell, et al., 1984gas phase; B,M
Quantity Value Units Method Reference Comment
Δr20.4cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr12.50kcal/molTDAsMagnera, Caldwell, et al., 1984gas phase; B

C2H7OS+ + Dimethyl Sulfoxide = (C2H7OS+ • Dimethyl Sulfoxide)

By formula: C2H7OS+ + C2H6OS = (C2H7OS+ • C2H6OS)

Quantity Value Units Method Reference Comment
Δr30.8kcal/molPHPMSLau, Saluja, et al., 1980gas phase; switching reaction((CH3)2SOH+)(CH3)2CO; M
Quantity Value Units Method Reference Comment
Δr22.9cal/mol*KPHPMSLau, Saluja, et al., 1980gas phase; switching reaction((CH3)2SOH+)(CH3)2CO; M

(C2H7OS+ • Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (C2H7OS+ • 2Dimethyl Sulfoxide)

By formula: (C2H7OS+ • C2H6OS) + C2H6OS = (C2H7OS+ • 2C2H6OS)

Quantity Value Units Method Reference Comment
Δr21.3kcal/molPHPMSLau, Saluja, et al., 1980gas phase; Entropy change is questionable; M
Quantity Value Units Method Reference Comment
Δr10.9cal/mol*KPHPMSLau, Saluja, et al., 1980gas phase; Entropy change is questionable; M

(Potassium ion (1+) • 4Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Potassium ion (1+) • 5Dimethyl Sulfoxide)

By formula: (K+ • 4C2H6OS) + C2H6OS = (K+ • 5C2H6OS)

Quantity Value Units Method Reference Comment
Δr15.8kcal/molHPMSSunner, 1984gas phase; Entropy change is questionable; M
Quantity Value Units Method Reference Comment
Δr37.cal/mol*KHPMSSunner, 1984gas phase; Entropy change is questionable; M

(Potassium ion (1+) • 5Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Potassium ion (1+) • 6Dimethyl Sulfoxide)

By formula: (K+ • 5C2H6OS) + C2H6OS = (K+ • 6C2H6OS)

Quantity Value Units Method Reference Comment
Δr15.5kcal/molHPMSSunner, 1984gas phase; Entropy change is questionable; M
Quantity Value Units Method Reference Comment
Δr40.cal/mol*KHPMSSunner, 1984gas phase; Entropy change is questionable; M

C6H4FNO2- + Dimethyl Sulfoxide = (C6H4FNO2- • Dimethyl Sulfoxide)

By formula: C6H4FNO2- + C2H6OS = (C6H4FNO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr7.9 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.9343.PHPMSChowdhury, 1987gas phase; M

C6H4FNO2- + Dimethyl Sulfoxide = (C6H4FNO2- • Dimethyl Sulfoxide)

By formula: C6H4FNO2- + C2H6OS = (C6H4FNO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr8.2 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
8.2343.PHPMSChowdhury, 1987gas phase; M

C6H4ClNO2- + Dimethyl Sulfoxide = (C6H4ClNO2- • Dimethyl Sulfoxide)

By formula: C6H4ClNO2- + C2H6OS = (C6H4ClNO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr7.5 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.5343.PHPMSChowdhury, 1987gas phase; M

C6H4FNO2- + Dimethyl Sulfoxide = (C6H4FNO2- • Dimethyl Sulfoxide)

By formula: C6H4FNO2- + C2H6OS = (C6H4FNO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr7.8 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.8343.PHPMSChowdhury, 1987gas phase; M

C6H4ClNO2- + Dimethyl Sulfoxide = (C6H4ClNO2- • Dimethyl Sulfoxide)

By formula: C6H4ClNO2- + C2H6OS = (C6H4ClNO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr7.8 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.8343.PHPMSChowdhury, 1987gas phase; M

C6H4ClNO2- + Dimethyl Sulfoxide = (C6H4ClNO2- • Dimethyl Sulfoxide)

By formula: C6H4ClNO2- + C2H6OS = (C6H4ClNO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr7.6 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.6343.PHPMSChowdhury, 1987gas phase; M

C6H4N2O4- + Dimethyl Sulfoxide = (C6H4N2O4- • Dimethyl Sulfoxide)

By formula: C6H4N2O4- + C2H6OS = (C6H4N2O4- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr4.4 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
4.4343.PHPMSChowdhury, 1987gas phase; M

C6H4N2O4- + Dimethyl Sulfoxide = (C6H4N2O4- • Dimethyl Sulfoxide)

By formula: C6H4N2O4- + C2H6OS = (C6H4N2O4- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr6.2 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.2343.PHPMSChowdhury, 1987gas phase; M

C6H4N2O4- + Dimethyl Sulfoxide = (C6H4N2O4- • Dimethyl Sulfoxide)

By formula: C6H4N2O4- + C2H6OS = (C6H4N2O4- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr5.9 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
5.9343.PHPMSChowdhury, 1987gas phase; M

C7H7NO2- + Dimethyl Sulfoxide = (C7H7NO2- • Dimethyl Sulfoxide)

By formula: C7H7NO2- + C2H6OS = (C7H7NO2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr8.6 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
8.6343.PHPMSChowdhury, 1987gas phase; M

C6F4O2- + Dimethyl Sulfoxide = (C6F4O2- • Dimethyl Sulfoxide)

By formula: C6F4O2- + C2H6OS = (C6F4O2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr4.5 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
4.5343.PHPMSChowdhury, 1987gas phase; M

p-Benzoquinone anion + Dimethyl Sulfoxide = (p-Benzoquinone anion • Dimethyl Sulfoxide)

By formula: C6H4O2- + C2H6OS = (C6H4O2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr6.2 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.2343.PHPMSChowdhury, 1987gas phase; M

C7H4N2O2- + Dimethyl Sulfoxide = (C7H4N2O2- • Dimethyl Sulfoxide)

By formula: C7H4N2O2- + C2H6OS = (C7H4N2O2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr6.8 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.8343.PHPMSChowdhury, 1987gas phase; M

Potassium ion (1+) + Dimethyl Sulfoxide = (Potassium ion (1+) • Dimethyl Sulfoxide)

By formula: K+ + C2H6OS = (K+ • C2H6OS)

Quantity Value Units Method Reference Comment
Δr31.1kcal/molCIDTKlassen, Anderson, et al., 1996RCD
Δr35.kcal/molHPMSSunner, 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr31.cal/mol*KHPMSSunner, 1984gas phase; M

C4H2O3- + Dimethyl Sulfoxide = (C4H2O3- • Dimethyl Sulfoxide)

By formula: C4H2O3- + C2H6OS = (C4H2O3- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr6.7 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.7343.PHPMSChowdhury, 1987gas phase; M

C7H4N2O2- + Dimethyl Sulfoxide = (C7H4N2O2- • Dimethyl Sulfoxide)

By formula: C7H4N2O2- + C2H6OS = (C7H4N2O2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr6.6 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
6.6343.PHPMSChowdhury, 1987gas phase; M

2Dimethyl sulfide + Oxygen = 2Dimethyl Sulfoxide

By formula: 2C2H6S + O2 = 2C2H6OS

Quantity Value Units Method Reference Comment
Δr-66.36 ± 0.20kcal/molCmDouglas, 1946, 2liquid phase; Reanalyzed by Cox and Pilcher, 1970, Original value = -66.5 ± 0.2 kcal/mol; At 291°K; ALS

Dimethyl sulfone = Dimethyl Sulfoxide + 0.5Oxygen

By formula: C2H6O2S = C2H6OS + 0.5O2

Quantity Value Units Method Reference Comment
Δr58.16 ± 0.20kcal/molCmDouglas, 1946, 2liquid phase; Reanalyzed by Cox and Pilcher, 1970, Original value = 59.0 ± 0.2 kcal/mol; At 291°K; ALS

(Chlorine anion • 2Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Chlorine anion • 3Dimethyl Sulfoxide)

By formula: (Cl- • 2C2H6OS) + C2H6OS = (Cl- • 3C2H6OS)

Quantity Value Units Method Reference Comment
Δr14.9kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr29.8cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

(Chlorine anion • 3Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Chlorine anion • 4Dimethyl Sulfoxide)

By formula: (Cl- • 3C2H6OS) + C2H6OS = (Cl- • 4C2H6OS)

Quantity Value Units Method Reference Comment
Δr14.6kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr37.2cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

(Chlorine anion • 4Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Chlorine anion • 5Dimethyl Sulfoxide)

By formula: (Cl- • 4C2H6OS) + C2H6OS = (Cl- • 5C2H6OS)

Quantity Value Units Method Reference Comment
Δr13.8kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr40.2cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

(Iodide • 2Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Iodide • 3Dimethyl Sulfoxide)

By formula: (I- • 2C2H6OS) + C2H6OS = (I- • 3C2H6OS)

Quantity Value Units Method Reference Comment
Δr11.6kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr25.1cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

(Bromine anion • 2Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Bromine anion • 3Dimethyl Sulfoxide)

By formula: (Br- • 2C2H6OS) + C2H6OS = (Br- • 3C2H6OS)

Quantity Value Units Method Reference Comment
Δr13.6kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr27.5cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

(Chlorine anion • Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Chlorine anion • 2Dimethyl Sulfoxide)

By formula: (Cl- • C2H6OS) + C2H6OS = (Cl- • 2C2H6OS)

Quantity Value Units Method Reference Comment
Δr16.0kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr23.8cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

(Iodide • Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Iodide • 2Dimethyl Sulfoxide)

By formula: (I- • C2H6OS) + C2H6OS = (I- • 2C2H6OS)

Quantity Value Units Method Reference Comment
Δr12.8kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr22.0cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

(Bromine anion • Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Bromine anion • 2Dimethyl Sulfoxide)

By formula: (Br- • C2H6OS) + C2H6OS = (Br- • 2C2H6OS)

Quantity Value Units Method Reference Comment
Δr14.5kcal/molPHPMSMagnera, Caldwell, et al., 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr22.4cal/mol*KPHPMSMagnera, Caldwell, et al., 1984gas phase; M

Sodium ion (1+) + Dimethyl Sulfoxide = (Sodium ion (1+) • Dimethyl Sulfoxide)

By formula: Na+ + C2H6OS = (Na+ • C2H6OS)

Quantity Value Units Method Reference Comment
Δr31.1kcal/molCIDKlassen, Anderson, et al., 1996RCD

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
31.0298.IMREMcMahon and Ohanessian, 2000Anchor alanine=39.89; RCD

(Potassium ion (1+) • 2Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Potassium ion (1+) • 3Dimethyl Sulfoxide)

By formula: (K+ • 2C2H6OS) + C2H6OS = (K+ • 3C2H6OS)

Quantity Value Units Method Reference Comment
Δr20.kcal/molHPMSSunner, 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr28.cal/mol*KHPMSSunner, 1984gas phase; M

(Potassium ion (1+) • 3Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Potassium ion (1+) • 4Dimethyl Sulfoxide)

By formula: (K+ • 3C2H6OS) + C2H6OS = (K+ • 4C2H6OS)

Quantity Value Units Method Reference Comment
Δr16.kcal/molHPMSSunner, 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr30.cal/mol*KHPMSSunner, 1984gas phase; M

(Potassium ion (1+) • Dimethyl Sulfoxide) + Dimethyl Sulfoxide = (Potassium ion (1+) • 2Dimethyl Sulfoxide)

By formula: (K+ • C2H6OS) + C2H6OS = (K+ • 2C2H6OS)

Quantity Value Units Method Reference Comment
Δr29.kcal/molHPMSSunner, 1984gas phase; M
Quantity Value Units Method Reference Comment
Δr34.cal/mol*KHPMSSunner, 1984gas phase; M

C7H4N2O2- + Dimethyl Sulfoxide = (C7H4N2O2- • Dimethyl Sulfoxide)

By formula: C7H4N2O2- + C2H6OS = (C7H4N2O2- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr16.0kcal/molPHPMSChowdhury, 1987gas phase; M
Quantity Value Units Method Reference Comment
Δr33.6cal/mol*KPHPMSChowdhury, 1987gas phase; M

C6H4NO3- + Dimethyl Sulfoxide = (C6H4NO3- • Dimethyl Sulfoxide)

By formula: C6H4NO3- + C2H6OS = (C6H4NO3- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr7.4 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

C6H4NO3- + Dimethyl Sulfoxide = (C6H4NO3- • Dimethyl Sulfoxide)

By formula: C6H4NO3- + C2H6OS = (C6H4NO3- • C2H6OS)

Quantity Value Units Method Reference Comment
Δr5.9 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

1,4-Naphthalenedione anion + Dimethyl Sulfoxide = C12H12O3S-

By formula: C10H6O2- + C2H6OS = C12H12O3S-

Quantity Value Units Method Reference Comment
Δr5.7 ± 1.6kcal/molIMREChowdhury, Grimsrud, et al., 1987gas phase; Free energy affinity at 70°C.; B

F6S- + Dimethyl Sulfoxide = (F6S- • Dimethyl Sulfoxide)

By formula: F6S- + C2H6OS = (F6S- • C2H6OS)

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.2308.PHPMSKnighton, Zook, et al., 1990gas phase; M

Perfluoro(methylcyclohexane) anion + Dimethyl Sulfoxide = (Perfluoro(methylcyclohexane) anion • Dimethyl Sulfoxide)

By formula: C7F14- + C2H6OS = (C7F14- • C2H6OS)

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
7.7308.PHPMSKnighton, Zook, et al., 1990gas phase; M

1,4-Naphthalenedione anion + Dimethyl Sulfoxide = (1,4-Naphthalenedione anion • Dimethyl Sulfoxide)

By formula: C10H6O2- + C2H6OS = (C10H6O2- • C2H6OS)

Free energy of reaction

ΔrG° (kcal/mol) T (K) Method Reference Comment
5.7343.PHPMSChowdhury, 1987gas phase; M

Henry's Law data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry 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: 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
>50000. CN/A 
1400. XN/AValue given here as quoted by missing citation.

IR Spectrum

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Data compiled by: Coblentz Society, Inc.

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


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, IR Spectrum, 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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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, 1990.
NIST MS number 118614

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References

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, IR Spectrum, Mass spectrum (electron ionization), Notes

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

Masuda, Nagano, et al., 1994
Masuda, N.; Nagano, Y.; Sakiyama, M., Standard molar enthalpy of formation of (CH3)2SO, dimethylsulfoxide, by combustion calorimetry, J. Chem. Thermodyn., 1994, 26, 971-975. [all data]

Clever and Westrum, 1970
Clever, H.L.; Westrum, E.F., Jr., Dimethylsulfoxide and dimethylsulfone. Heat capacities, enthalpies of fusion, and thermodynamic properties, J. Phys. Chem., 1970, 74, 1309-1317. [all data]

Grolier, Roux-Desgranges, et al., 1993
Grolier, J.-P.E.; Roux-Desgranges, G.; Berkane, M.; Jimenez, E.; Wilhelm, E., Heat capacities and densities of mixtures of very polar substances 2. Mixtures containing N,N-dimethylformamide, J. Chem. Thermodynam., 1993, 25(1), 41-50. [all data]

Barta, Kooner, et al., 1989
Barta, L.; Kooner, Z.S.; Hepler, L.G.; Roux-Desgranges, G.; Grolier, J.-P.E., Thermal and volumetric properties of chloroform dimethylsulfoxide: Thermodynamic analysis using the ideal associated solution model, J. Solution Chem., 1989, 18(7), 663-673. [all data]

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Rodante, F.; Marrosu, G., Excess molar isobaric heat capacities and excess molar enthalpies for water-dimethylsulfoxide mixtures at 25°C, Thermochim. Acta, 1988, 136, 209-218. [all data]

Lankford and Criss, 1987
Lankford, J.I.; Criss, C.M., Partial molar heat caqpacities of selected electrolytes and benzene in methanol and dimethyldulfoxide at 25, 40 and 80°C, J. Solution Chem., 1987, 16(11), 885-906. [all data]

de Visser and Somsen, 1979
de Visser, C.; Somsen, G., Thermochemical behavior of mixtures of N,N-dimethylformamide with dimethylsulfoxide, acetonitrile, and N-methylformamide: volumes and heat capacities, J. Solution Chem., 1979, 8, 593-600. [all data]

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De Visser, C.; Heuvelsland, W.J.M.; Dunn, L.A.; Somsen, G., Some properties of binary aqueous liquid mixtures, J. Chem. Soc., Faraday Trans.1, 1978, 74, 1159-1169. [all data]

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Kenttmaa, J.; Lindberg, J.J., Volumes and heats of mixing of dimethyl sulfoxide-water solutions, Suom. Kemistilehti, 1960, B33, 32-35. [all data]

Lindberg and Stenholm, 1966
Lindberg, J.J.; Stenholm, V., Viscosities, Densities, and Related Properties of Binary Mixtures Containing Dimethyl Sulphoxide and Mono-Subst. Benzenes or Guaiacol, Suom. Kemistiseuran Tied., 1966, 75, 22. [all data]

Douglas, 1948
Douglas, T.B., Vapor Pressure of Methyl Sulfoxide from 20 to 50 deg. Calculation of the Heat of Vaporization, J. Am. Chem. Soc., 1948, 70, 2001. [all data]

Douglas, 1946
Douglas, T.B., Heats of Formation of Liquid Methyl Sulfoxide and Crystalline Methyl Sulfone at 18 deg., J. Am. Chem. Soc., 1946, 68, 1072. [all data]

Clever and Westrum, 1970, 2
Clever, H.L.; Westrum, E.F., Dimethyl sulfoxide and dimethyl sulfone. Heat capacities, enthalpies of fusion, and thermodynamic properties., J. Phys. Chem., 1970, 74, 1309. [all data]

Douglas, 1948, 2
Douglas, T.B., Vapor pressure of methyl sulfoxide from 20 to 50°. Calculation of the heat of vaporization, J. Am. Chem. Soc., 1948, 70, 2001-20. [all data]

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Douglas, Thomas B., Vapor Pressure of Methyl Sulfoxide from 20 to 50°. Calculation of the Heat of Vaporization, J. Am. Chem. Soc., 1948, 70, 6, 2001-2002, https://doi.org/10.1021/ja01186a005 . [all data]

Al-Najjar and Al-Sammerrai, 2007
Al-Najjar, Hazim; Al-Sammerrai, Dhoaib, Thermogravimetric determination of the heat of vaporization of some highly polar solvents, J. Chem. Technol. Biotechnol., 2007, 37, 3, 145-152, https://doi.org/10.1002/jctb.280370302 . [all data]

Dykyj, Svoboda, et al., 1999
Dykyj, J.; Svoboda, J.; Wilhoit, R.C.; Frenkel, M.L.; Hall, K.R., Vapor Pressure of Chemicals: Part A. Vapor Pressure and Antoine Constants for Hydrocarbons and Sulfur, Selenium, Tellurium and Hydrogen Containing Organic Compounds, Springer, Berlin, 1999, 373. [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]

Sassa, Konishi, et al., 1974
Sassa, Yoshimasa; Konishi, Ryoichi; Katayama, Takashi, Isothermal vapor-liquid equilibrium data of DMSO [dimethyl sulfoxide] solutions by total pressure method. DMSO-acetone, DMSO-tetrahydrofuran, and DMSO-ethyl acetate systems, J. Chem. Eng. Data, 1974, 19, 1, 44-48, https://doi.org/10.1021/je60060a004 . [all data]

Jakli and Alexander Van Hook, 1972
Jakli, Gyorgy; Alexander Van Hook, W., The vapor pressures of dimethyl sulfoxide and hexadeuterodimethyl sulfoxide from about 313 to 453 K, The Journal of Chemical Thermodynamics, 1972, 4, 6, 857-864, https://doi.org/10.1016/0021-9614(72)90007-9 . [all data]

Boublik, Fried, et al., 1984
Boublik, T.; Fried, V.; Hala, E., The Vapour Pressures of Pure Substances: Selected Values of the Temperature Dependence of the Vapour Pressures of Some Pure Substances in the Normal and Low Pressure Region, 2nd ed., Elsevier, New York, 1984, 972. [all data]

NISHIMURA, NAKAYAMA, et al., 1972
NISHIMURA, MICHIKO; NAKAYAMA, MUTSUO; YANO, TAKEO, VAPOR PRESSURE OF PURE DMSO AND VAPOR-LIQUID EQUILIBRIA IN DMSO-H2O SYSTEM UNDER ISOBARIC CONDITIONS, J. Chem. Eng. Japan / JCEJ, 1972, 5, 3, 223-226, https://doi.org/10.1252/jcej.5.223 . [all data]

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Meszaros, S., Period. Polytech., Chem. Eng., 1969, 13, 1-2, 79. [all data]

Jakli and van Hook, 1972
Jakli, G.; van Hook, W.A., The Vapor Pressures of Dimethyl Sulfoxide and Hexadeuterodimethyl Sulfoxide from about 313 to 453 K, J. Chem. Thermodyn., 1972, 4, 6, 857-864, https://doi.org/10.1016/0021-9614(72)90007-9 . [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]

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Bartmess, J.E.; Scott, J.A.; McIver, R.T., Jr., The gas phase acidity scale from methanol to phenol, J. Am. Chem. Soc., 1979, 101, 6047. [all data]

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Cumming, J.B.; Kebarle, P., Summary of gas phase measurements involving acids AH. Entropy changes in proton transfer reactions involving negative ions. Bond dissociation energies D(A-H) and electron affinities EA(A), Can. J. Chem., 1978, 56, 1. [all data]

Sieck, 1985
Sieck, L.W., Thermochemistry of Solvation of NO2- and C6H5NO2- by Polar Molecules in the Vapor Phase. Comparison with Cl- and Variation with Ligand Structure., J. Phys. Chem., 1985, 89, 25, 5552, https://doi.org/10.1021/j100271a049 . [all data]

Chowdhury, Grimsrud, et al., 1987
Chowdhury, S.; Grimsrud, E.P.; Kebarle, P., Bonding of Charged Delocalized Anions to Protic and Dipolar Aprotic Solvent Molecules, J. Phys. Chem., 1987, 91, 10, 2551, https://doi.org/10.1021/j100294a021 . [all data]

Chowdhury, 1987
Chowdhury, S. Grimsrud, Bonding of Charge Delocalized Anions to Protic and Dipolar Aprotic Solvents, J. Phys. Chem., 1987, 91, 10, 2551, https://doi.org/10.1021/j100294a021 . [all data]

Magnera, Caldwell, et al., 1984
Magnera, T.F.; Caldwell, G.; Sumner, J.; Ikuta, S.; Kebarle, P., Solvation of the halide anions in dimethyl sulfoxide. Factors involved in enhanced reactivity of negative ions in dipolar aprotic solvents, J. Am. Chem. Soc., 1984, 106, 6140. [all data]

Caldwell, Masucci, et al., 1989
Caldwell, G.W.; Masucci, J.A.; Ikonomou, M.G., Negative Ion Chemical Ionization Mass Spectrometry - Binding of Molecules to Bromide and Iodide Anions, Org. Mass Spectrom., 1989, 24, 1, 8, https://doi.org/10.1002/oms.1210240103 . [all data]

Lau, Saluja, et al., 1980
Lau, Y.K.; Saluja, P.P.S.; Kebarle, P., The Proton in Dimethyl Sulfoxide and Acetone. Results from Gas - Phase Ion Equilibria Involving (Me2SO)nH+ and (Me2CO)nH+, J. Am. Chem. Soc., 1980, 102, 25, 7429, https://doi.org/10.1021/ja00545a004 . [all data]

Sunner, 1984
Sunner, J. Kebarle, Ion - Solvent Molecule Interactions in the Gas Phase. The Potassium Ion and Me2SO, DMA, DMF, and Acetone, J. Am. Chem. Soc., 1984, 106, 21, 6135, https://doi.org/10.1021/ja00333a002 . [all data]

Klassen, Anderson, et al., 1996
Klassen, J.S.; Anderson, S.G.; Blades, A.T.; Kebarle, P., Reaction Enthalpies for M+L = M+ + L, Where M+ = Na+ and K+ and L = Acetamide, N-Methylacetamide, N,N-Dimethylacetamide, Glycine, and Glycylglycine, from Determinations of the Collision-Induced Dissociation Thresholds, J. Phys. Chem., 1996, 100, 33, 14218, https://doi.org/10.1021/jp9608382 . [all data]

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Douglas, T.B., Heats of formation of liquid methyl sulfoxide and crystalline methyl sulfone at 18°, J. Am. Chem. Soc., 1946, 68, 1072-1076. [all data]

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

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McMahon, T.B.; Ohanessian, G., An Experimental and Ab Initio Study of the Nature of the Binding in Gas-Phase Complexes of Sodium Ions, Chem. Eur. J., 2000, 6, 16, 2931, https://doi.org/10.1002/1521-3765(20000818)6:16<2931::AID-CHEM2931>3.0.CO;2-7 . [all data]

Knighton, Zook, et al., 1990
Knighton, W.B.; Zook, D.R.; Grimsrud, E.P., Cluster-Assisted Decomposition Reactions of the Molecular Anions of SF6 and C7F14, J. Am. Soc. Mass Spectrom., 1990, 1, 5, 372, https://doi.org/10.1016/1044-0305(90)85017-G . [all data]


Notes

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Henry's Law data, IR Spectrum, Mass spectrum (electron ionization), References