Sulfur trifluoride
- Formula: F3S
- Molecular weight: 89.060
- IUPAC Standard InChIKey: PSCXEUSWZWRCMQ-UHFFFAOYSA-N
- CAS Registry Number: 30937-38-3
- Chemical structure:
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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.
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | -120.23 | kcal/mol | Review | Chase, 1998 | Data last reviewed in June, 1977 |
Quantity | Value | Units | Method | Reference | Comment |
S°gas,1 bar | 68.365 | cal/mol*K | Review | Chase, 1998 | Data last reviewed in June, 1977 |
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 6000. |
---|---|
A | 18.89000 |
B | 0.840722 |
C | -0.234059 |
D | 0.021282 |
E | -0.374292 |
F | -127.1490 |
G | 88.87990 |
H | -120.2270 |
Reference | Chase, 1998 |
Comment | Data last reviewed in June, 1977 |
Reaction thermochemistry data
Go To: Top, Gas phase thermochemistry data, 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: John E. Bartmess
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: (F4S- • 4294967295F3S) + F3S = F4S-
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 42.4 ± 3.2 | kcal/mol | Ther | Miller, Miller, et al., 1995 | gas phase |
ΔrH° | 43.5 ± 7.6 | kcal/mol | Ther | Viggiano, MIller, et al., 1991 | gas phase; Between mCF3-nitrobenzene, C6F5NO2 |
ΔrH° | 63.2 ± 9.3 | kcal/mol | Ther | Babcock and Streit, 1981 | gas phase; EA: between NO2-, HS- |
Vibrational and/or electronic energy levels
Go To: Top, Gas phase thermochemistry data, Reaction thermochemistry data, 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: Marilyn E. Jacox
State: X
Vib. sym. |
No. | Approximate type of mode |
cm-1 | Med. | Method | References | |
---|---|---|---|---|---|---|---|
Eq. SF2 s-str. | 843.8 | Ar | IR | Hassanzadeh and Andrews, 1992 | |||
Ax. SF2 a-str. | 681.8 | Ar | IR | Smardzewski and Fox, 1976 Smardzewski and Fox, 1977 Hassanzadeh and Andrews, 1992 | |||
Additional references: Jacox, 1994, page 226; Colussi, Morton, et al., 1974; Morton, Preston, et al., 1978
References
Go To: Top, Gas phase thermochemistry data, Reaction thermochemistry data, 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
Chase, M.W., Jr.,
NIST-JANAF Themochemical Tables, Fourth Edition,
J. Phys. Chem. Ref. Data, Monograph 9, 1998, 1-1951. [all data]
Miller, Miller, et al., 1995
Miller, A.E.S.; Miller, T.M.; Viggiano, A.A.; Morris, R.A.; Vandoren, J.M.; Arnold, S.T.; Paulson, J.,
Negative ion chemistry of SF4,
J. Chem. Phys., 1995, 102, 22, 8865, https://doi.org/10.1063/1.468940
. [all data]
Viggiano, MIller, et al., 1991
Viggiano, A.A.; MIller, T.M.; Miller, A.E.S.; Morris, R.A.; Van Doren, J.M.; Paulson, J.F.,
SF4: Electron Affinity Determination by Charge Transfer Reactions,
Int. J. Mass Spectrom. Ion Proc., 1991, 109, 327, https://doi.org/10.1016/0168-1176(91)85112-Y
. [all data]
Babcock and Streit, 1981
Babcock, L.M.; Streit, G.E.,
Negative ion-molecule reactions of SF4,
J. Chem. Phys., 1981, 75, 3864. [all data]
Hassanzadeh and Andrews, 1992
Hassanzadeh, P.; Andrews, L.,
Matrix reactions of sulfur atoms and fluorine. Infrared spectra of sulfur monofluoride, sulfur difluoride and sulfur trifluoride in solid argon,
J. Phys. Chem., 1992, 96, 1, 79, https://doi.org/10.1021/j100180a018
. [all data]
Smardzewski and Fox, 1976
Smardzewski, R.R.; Fox, W.B.,
Photolysis of sulfur tetrafluoride in an argon matrix: infrared evidence for formation of the SF3· radical and SF2.,
J. Fluorine Chem., 1976, 7, 1-3, 353, https://doi.org/10.1016/S0022-1139(00)84007-5
. [all data]
Smardzewski and Fox, 1977
Smardzewski, R.R.; Fox, W.B.,
Vacuum ultraviolet photolysis of sulfur hexafluoride and its derivatives in argon matrices. The infrared spectrum of the SF5 radical,
J. Chem. Phys., 1977, 67, 5, 2309, https://doi.org/10.1063/1.435066
. [all data]
Jacox, 1994
Jacox, M.E.,
Vibrational and electronic energy levels of polyatomic transient molecules, American Chemical Society, Washington, DC, 1994, 464. [all data]
Colussi, Morton, et al., 1974
Colussi, A.J.; Morton, J.R.; Preston, K.F.; Fessenden, R.W.,
ESR spectra of PF2 and SF3 radicals,
J. Chem. Phys., 1974, 61, 3, 1247, https://doi.org/10.1063/1.1682004
. [all data]
Morton, Preston, et al., 1978
Morton, J.R.; Preston, K.F.; Strach, S.J.,
The EPR spectrum of SF3 trapped in SF3BF4 crystals,
J. Chem. Phys., 1978, 69, 4, 1392, https://doi.org/10.1063/1.436766
. [all data]
Notes
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- Symbols used in this document:
S°gas,1 bar Entropy of gas at standard conditions (1 bar) ΔfH°gas Enthalpy of formation of gas at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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