sulfur
- Formula: S
- Molecular weight: 32.065
- IUPAC Standard InChIKey: NINIDFKCEFEMDL-UHFFFAOYSA-N
- CAS Registry Number: 7704-34-9
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: Insoluble sulfur; Sulphur; Sulfur atom
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Condensed phase thermochemistry data
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔfH°liquid | 1.85 | kJ/mol | Review | Chase, 1998 | Data last reviewed in September, 1977 |
| Quantity | Value | Units | Method | Reference | Comment |
| S°liquid,1 bar | 36.85 | J/mol*K | Review | Chase, 1998 | Data last reviewed in September, 1977 |
| Quantity | Value | Units | Method | Reference | Comment |
| S°solid,1 bar | 32.054 ± 0.050 | J/mol*K | Review | Cox, Wagman, et al., 1984 | rhombic phase; CODATA Review value |
Liquid 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 (J/mol*K)
H° = standard enthalpy (kJ/mol)
S° = standard entropy (J/mol*K)
t = temperature (K) / 1000.
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| Temperature (K) | 388.36 to 432. | 432. to 882.117 |
|---|---|---|
| A | -4540.970 | -37.93350 |
| B | 26065.60 | 133.2420 |
| C | -55520.70 | -95.32450 |
| D | 42012.20 | 24.00940 |
| E | 54.58860 | 7.654530 |
| F | 787.8070 | 29.78810 |
| G | -10826.30 | -13.15340 |
| H | 1.853781 | 1.853781 |
| Reference | Chase, 1998 | Chase, 1998 |
| Comment | Data last reviewed in September, 1977 | Data last reviewed in September, 1977 |
Solid 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 (J/mol*K)
H° = standard enthalpy (kJ/mol)
S° = standard entropy (J/mol*K)
t = temperature (K) / 1000.
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| Temperature (K) | 298. to 388.36 | 298. to 388.36 |
|---|---|---|
| A | 21.21978 | 24.23749 |
| B | 3.865858 | -4.983060 |
| C | 22.27461 | 33.00900 |
| D | -10.31908 | -15.29616 |
| E | -0.122518 | -0.182237 |
| F | -7.085604 | -7.516263 |
| G | 54.99575 | 61.49141 |
| H | 0.000000 | 0.360001 |
| Reference | Chase, 1998 | Chase, 1998 |
| Comment | orthorhombic phase; Data last reviewed in September, 1977 | monoclinic phase; Data last reviewed in September, 1977 |
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 by: Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| Tc | 1313. | K | N/A | Rau, Kutty, et al., 1973 | Uncertainty assigned by TRC = 1.31 K |
| Quantity | Value | Units | Method | Reference | Comment |
| Pc | 182.081 | bar | N/A | Rau, Kutty, et al., 1973 | Uncertainty assigned by TRC = 0.1818 bar; Vapour pressure measured to 1273 K |
| Quantity | Value | Units | Method | Reference | Comment |
| ρc | 17.6 | mol/l | N/A | Rau, Kutty, et al., 1973 | Uncertainty assigned by TRC = 0.175 mol/l; Density measured to 1273 K |
Reaction 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:
B - John E. Bartmess
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
By formula: (HS- • 4294967295S) + S = HS-
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 502.62 | kJ/mol | N/A | Chaibi, Delsart, et al., 2006 | gas phase; For H(32)S-. Given: 2.3147282(17) eV; B |
| ΔrH° | 502.83 ± 0.75 | kJ/mol | Ther | Breyer, Frey, et al., 1981 | gas phase; B |
| ΔrH° | 503.8 ± 9.2 | kJ/mol | Ther | Bartmess, Scott, et al., 1979 | gas phase; value altered from reference due to change in acidity scale; B |
| ΔrH° | 358.0 | kJ/mol | Ther | Shiell, Hu, et al., 1900 | gas phase; 0K:350.125±0.009 kcal/mol, corr to 298K from Gurvich, Veyts, et al., With EA( Breyer, Frey, et al., 1981)BDE(0K)=89.97±0.05; B |
(CAS Reg. No. 12269-52-2 • 4294967295) +
= CAS Reg. No. 12269-52-2
By formula: (CAS Reg. No. 12269-52-2 • 4294967295S) + S = CAS Reg. No. 12269-52-2
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 489. ± 39. | kJ/mol | N/A | Polak, Fiala, et al., 1991 | gas phase; ΔHf(AH) from data on HOS-; B |
| ΔrH° | 485.8 ± 8.8 | kJ/mol | Ther | Feldman, 1970 | gas phase; B |
(CAS Reg. No. 66524-41-2 • 4294967295) +
= CAS Reg. No. 66524-41-2
By formula: (CAS Reg. No. 66524-41-2 • 4294967295S) + S = CAS Reg. No. 66524-41-2
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 349. ± 9.6 | kJ/mol | N/A | Hunsicker, Jones, et al., 1995 | gas phase; Vertical Detachment Energy: 3.55 eV. An isomer exists with EA=2.26 eV; B |
(CAS Reg. No. 66524-43-4 • 4294967295) +
= CAS Reg. No. 66524-43-4
By formula: (CAS Reg. No. 66524-43-4 • 4294967295S) + S = CAS Reg. No. 66524-43-4
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 262. ± 9.2 | kJ/mol | N/A | Hunsicker, Jones, et al., 1995 | gas phase; Vertical Detachment Energy: 3.55 eV. An isomer exists with EA=2.26 eV; B |
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 32.5 ± 0.3 | kJ/mol | Eqk | Bechtold, 1965 | gas phase; Reanalyzed by Cox and Pilcher, 1970, Original value = 30.3 kJ/mol; ALS |
(CAS Reg. No. 12597-11-4 • 4294967295) +
= CAS Reg. No. 12597-11-4
By formula: (CAS Reg. No. 12597-11-4 • 4294967295S) + S = CAS Reg. No. 12597-11-4
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 336. ± 7.5 | kJ/mol | N/A | Hunsicker, Jones, et al., 1995 | gas phase; Vertical Detachment Energy: 2.97±0.03 eV); B |
(CAS Reg. No. 37301-16-9 • 4294967295) +
= CAS Reg. No. 37301-16-9
By formula: (CAS Reg. No. 37301-16-9 • 4294967295S) + S = CAS Reg. No. 37301-16-9
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 298. ± 6.3 | kJ/mol | N/A | Hunsicker, Jones, et al., 1995 | gas phase; Vertical Detachment Energy: 2.42±0.05 eV); B |
(CAS Reg. No. 184378-98-1 • 4294967295) +
= CAS Reg. No. 184378-98-1
By formula: (CAS Reg. No. 184378-98-1 • 4294967295S) + S = CAS Reg. No. 184378-98-1
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 329. ± 7.9 | kJ/mol | N/A | Hunsicker, Jones, et al., 1995 | gas phase; Vertical Detachment Energy: 3.87 eV.; B |
By formula: (S2- • 4294967295S) + S = S2-
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 388. ± 22. | kJ/mol | N/A | Moran and Ellison, 1988 | gas phase; B |
By formula: (S3- • 4294967295S) + S = S3-
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 302. ± 22. | kJ/mol | N/A | Nimlos and Ellison, 1986 | gas phase; B |
By formula: (FS- • 4294967295S) + S = FS-
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 236. ± 6.3 | kJ/mol | N/A | Polak, Gilles, et al., 1992 | gas phase; B |
Ion clustering data
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: John E. Bartmess
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
By formula: (FS- • 4294967295S) + S = FS-
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 236. ± 6.3 | kJ/mol | N/A | Polak, Gilles, et al., 1992 | gas phase |
By formula: (HS- • 4294967295S) + S = HS-
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 502.62 | kJ/mol | N/A | Chaibi, Delsart, et al., 2006 | gas phase; For H(32)S-. Given: 2.3147282(17) eV |
| ΔrH° | 502.83 ± 0.75 | kJ/mol | Ther | Breyer, Frey, et al., 1981 | gas phase |
| ΔrH° | 503.8 ± 9.2 | kJ/mol | Ther | Bartmess, Scott, et al., 1979 | gas phase; value altered from reference due to change in acidity scale |
| ΔrH° | 358.0 | kJ/mol | Ther | Shiell, Hu, et al., 1900 | gas phase; 0K:350.125±0.009 kcal/mol, corr to 298K from Gurvich, Veyts, et al., With EA( Breyer, Frey, et al., 1981)BDE(0K)=89.97±0.05 |
By formula: (S2- • 4294967295S) + S = S2-
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 388. ± 22. | kJ/mol | N/A | Moran and Ellison, 1988 | gas phase |
By formula: (S3- • 4294967295S) + S = S3-
| Quantity | Value | Units | Method | Reference | Comment |
|---|---|---|---|---|---|
| ΔrH° | 302. ± 22. | kJ/mol | N/A | Nimlos and Ellison, 1986 | gas phase |
References
Go To: Top, Condensed phase thermochemistry data, Phase change data, Reaction thermochemistry data, Ion clustering data, NIST Free Links, NIST Subscription Links, 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]
Cox, Wagman, et al., 1984
Cox, J.D.; Wagman, D.D.; Medvedev, V.A.,
CODATA Key Values for Thermodynamics, Hemisphere Publishing Corp., New York, 1984, 1. [all data]
Rau, Kutty, et al., 1973
Rau, H.; Kutty, T.R.N.; Guedes de Carvalho, J.R.F.,
High temperature saturated vapor pressure of sulphur and the estimation of its critical quantities,
J. Chem. Thermodyn., 1973, 5, 291-302. [all data]
Chaibi, Delsart, et al., 2006
Chaibi, W.; Delsart, C.; Drag, C.; Blondel, C.,
High precision measurement of the (SH)-S-32 electron affinity by laser detachment microscopy,
J. Molec. Spectros., 2006, 239, 1, 11-15, https://doi.org/10.1016/j.jms.2006.05.012
. [all data]
Breyer, Frey, et al., 1981
Breyer, F.; Frey, P.; Hotop, H.,
High Resolution Photoelectron Spectrometry of Negative Ions: Rotational Transitions in Laser-Photodetachment of OH-, SH-, and SD-,
Z. Phys. A, 1981, 300, 1, 7, https://doi.org/10.1007/BF01412609
. [all data]
Bartmess, Scott, et al., 1979
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]
Shiell, Hu, et al., 1900
Shiell, R.C.; Hu, X.K.; Hu, Q.J.; Hepburn, J.W.,
A determination of the bond dissociation energy (D-0(H-SH)): Threshold ion-pair production spectroscopy (TIPPS) of a triatomic molecule,
J. Phys. Chem. A, 1900, 104, 19, 4339-4342, https://doi.org/10.1021/jp000025k
. [all data]
Gurvich, Veyts, et al.
Gurvich, L.V.; Veyts, I.V.; Alcock, C.B.,
Hemisphere Publishing, NY, 1989, V. 1 2, Thermodynamic Properties of Individual Substances, 4th Ed. [all data]
Polak, Fiala, et al., 1991
Polak, M.L.; Fiala, B.L.; Lineberger, W.C.; Ervin, K.M.,
The Ultraviolet Photoelectron Spectrum of SO-,
J. Chem. Phys., 1991, 94, 10, 6926, https://doi.org/10.1063/1.460223
. [all data]
Feldman, 1970
Feldman, D.,
Photoablosung von Elektronen bei einigen Stabilen Negativen Ionen,
Z. Naturfor., 1970, 25A, 621. [all data]
Hunsicker, Jones, et al., 1995
Hunsicker, S.; Jones, R.O.; Gantefor, G.,
Rings and chains in sulfur cluster anions S- to S-9(-): Theory (simulated annealing) and experiment (photoelectron detachment),
J. Chem. Phys., 1995, 102, 15, 5917, https://doi.org/10.1063/1.469326
. [all data]
Bechtold, 1965
Bechtold, V.E.,
Bestimmung des Standardwertes der freien Reaktionsenthalpie für die Bildung von Kohlenoxysulfid aus Kohlenmonoxyd,
Ber. Bunsenges. Phys. Chem., 1965, 69, 326-328. [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]
Moran and Ellison, 1988
Moran, S.; Ellison, G.B.,
Photoelectron Spectroscopy of Sulfur Ions,
J. Phys. Chem., 1988, 92, 7, 1794, https://doi.org/10.1021/j100318a021
. [all data]
Nimlos and Ellison, 1986
Nimlos, M.R.; Ellison, G.B.,
Photoelectron spectroscopy of SO2-, S3-, and S2O-,
J. Phys. Chem., 1986, 90, 2574. [all data]
Polak, Gilles, et al., 1992
Polak, M.L.; Gilles, M.K.; Lineberger, W.C.,
Photoelectron Spectroscopy of SF-,
J. Chem. Phys., 1992, 96, 9, 7191, https://doi.org/10.1063/1.462526
. [all data]
Notes
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- Symbols used in this document:
Pc Critical pressure S°liquid,1 bar Entropy of liquid at standard conditions (1 bar) S°solid,1 bar Entropy of solid at standard conditions (1 bar) Tc Critical temperature ΔfH°liquid Enthalpy of formation of liquid at standard conditions ΔrH° Enthalpy of reaction at standard conditions ρc Critical density - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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