Krypton
- Formula: Kr
- Molecular weight: 83.798
- IUPAC Standard InChIKey: DNNSSWSSYDEUBZ-UHFFFAOYSA-N
- CAS Registry Number: 7439-90-9
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: Kr; UN 1056; UN 1970
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Data at other public NIST sites:
- NIST Atomic Spectra Database - Lines Holdings (on physics web site)
- NIST Atomic Spectra Database - Levels Holdings (on physics web site)
- NIST Atomic Spectra Database - Ground states and ionization energies (on physics web site)
- Gas Phase Kinetics Database
- X-ray Photoelectron Spectroscopy Database, version 5.0
- X-ray Photoelectron Spectroscopy Database, version 5.0
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Gas phase thermochemistry data
Go To: Top, Reaction thermochemistry data, Henry's Law data, References, Notes
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 |
---|---|---|---|---|---|
S°gas,1 bar | 39.2173 ± 0.0007 | cal/mol*K | Review | Cox, Wagman, et al., 1984 | CODATA Review value |
S°gas,1 bar | 39.216 | cal/mol*K | Review | Chase, 1998 | Data last reviewed in March, 1982 |
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.
View plot Requires a JavaScript / HTML 5 canvas capable browser.
Temperature (K) | 298. to 6000. |
---|---|
A | 4.967981 |
B | 1.159331×10-10 |
C | -3.783261×10-11 |
D | 3.645079×10-12 |
E | 7.639451×10-12 |
F | -1.481201 |
G | 45.22921 |
H | 0.000000 |
Reference | Chase, 1998 |
Comment | Data last reviewed in March, 1982 |
Reaction thermochemistry data
Go To: Top, Gas phase thermochemistry data, Henry's Law 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 as indicated in comments:
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias
B - John E. Bartmess
RCD - Robert C. Dunbar
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: Cs+ + Kr = (Cs+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.79 | kcal/mol | IMob | Gatland, 1984 | gas phase; M |
ΔrH° | 2.33 | kcal/mol | SCATTERING | Gislason, 1984 | gas phase; M |
ΔrH° | 2.72 | kcal/mol | IMob | Viehland, 1984 | gas phase; M |
ΔrH° | 3.1 | kcal/mol | IMob | Takebe, 1983 | gas phase; M |
ΔrH° | 3.07 | kcal/mol | IMob | Takebe, 1983 | gas phase; values form this reference are too high; M |
By formula: CH3+ + Kr = (CH3+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 44.0 | kcal/mol | PHPMS | McMahon, Heinis, et al., 1988 | gas phase; switching reaction(CH3+)N2, Entropy change calculated or estimated, uses MCA(N2) = 48.3 kcal/mol; Foster, Williamson, et al., 1974; M |
ΔrH° | 47.7 ± 2.5 | kcal/mol | ICR | Hovey and McMahon, 1987 | gas phase; switching reaction(CH3+)N2, Entropy change calculated or estimated; M |
By formula: Na+ + Kr = (Na+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 4.84 | kcal/mol | SCATTERING | Gislason, 1984 | gas phase; M |
ΔrH° | 5.08 | kcal/mol | IMob | Viehland, 1984 | gas phase; M |
ΔrH° | 5.8 | kcal/mol | DT | McKnight and Sawina, 1973 | gas phase; M |
ΔrH° | 6.57 | kcal/mol | IMob | Takebe, 1983 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 18.5 | cal/mol*K | DT | McKnight and Sawina, 1973 | gas phase; M |
By formula: Cl- + Kr = (Cl- • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.20 ± 0.10 | kcal/mol | LPES | Yourshaw, Lenzer, et al., 1998 | gas phase; Given: 0.0957(0.001) eV; B |
ΔrH° | 2.80 ± 0.40 | kcal/mol | TDAs | Wada, Kikkawa, et al., 2007 | gas phase; B |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | -2.86 ± 0.40 | kcal/mol | TDAs | Wada, Kikkawa, et al., 2007 | gas phase; B |
By formula: Br- + Kr = (Br- • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.10 ± 0.10 | kcal/mol | LPES | Yourshaw, Lenzer, et al., 1998 | gas phase; given: 0.0795(.001) eV; B |
ΔrH° | <2.70 | kcal/mol | TDAs | Wada, Kikkawa, et al., 2007 | gas phase; B |
ΔrH° | 2.00 | kcal/mol | Mobl | Gatland, 1984, 2 | gas phase; B,M |
By formula: Kr+ + Kr = (Kr+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 26.5 | kcal/mol | PI | Dehmer and Pratt, 1982 | gas phase; M |
ΔrH° | 26.3 | kcal/mol | PDiss | Abouaf, Huber, et al., 1978 | gas phase; M |
ΔrH° | 26.5 | kcal/mol | PI | Ng, Trevor, et al., 1977 | gas phase; M |
ΔrH° | 27.9 | kcal/mol | SCATTERING | Mittman and Weise, 1974 | gas phase; M |
By formula: K+ + Kr = (K+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 3.21 | kcal/mol | IMob | Gatland, 1984 | gas phase; M |
ΔrH° | 2.89 | kcal/mol | SCATTERING | Gislason, 1984 | gas phase; M |
ΔrH° | 2.94 | kcal/mol | IMob | Viehland, 1984 | gas phase; M |
ΔrH° | 3.71 | kcal/mol | IMob | Takebe, 1983 | gas phase; M |
By formula: Cu+ + Kr = (Cu+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.8 | kcal/mol | HPMS | El-Shall, Schriver, et al., 1989 | gas phase; Cu+ from laser desrption; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 18.8 | cal/mol*K | HPMS | El-Shall, Schriver, et al., 1989 | gas phase; Cu+ from laser desrption; M |
By formula: Li+ + Kr = (Li+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 10.6 | kcal/mol | SCATTERING | Gislason, 1984 | gas phase; M |
ΔrH° | 9.2 | kcal/mol | IMob | Viehland, 1984 | gas phase; M |
ΔrH° | 16.4 | kcal/mol | IMob | Takebe, 1983 | gas phase; M |
By formula: Rb+ + Kr = (Rb+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.64 | kcal/mol | IMob | Gatland, 1984 | gas phase; M |
ΔrH° | 2.67 | kcal/mol | IMob | Viehland, 1984 | gas phase; M |
ΔrH° | 3.34 | kcal/mol | IMob | Takebe, 1983 | gas phase; M |
By formula: (Kr+ • 2Kr) + Kr = (Kr+ • 3Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 5.57 ± 0.15 | kcal/mol | PHPMS | Hiraoka and Mori, 1990 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 17.8 | cal/mol*K | PHPMS | Hiraoka and Mori, 1990 | gas phase; M |
By formula: (Kr+ • 3Kr) + Kr = (Kr+ • 4Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.16 ± 0.15 | kcal/mol | PHPMS | Hiraoka and Mori, 1990 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 14.9 | cal/mol*K | PHPMS | Hiraoka and Mori, 1990 | gas phase; M |
By formula: (Kr+ • 4Kr) + Kr = (Kr+ • 5Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.05 ± 0.15 | kcal/mol | PHPMS | Hiraoka and Mori, 1990 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 15.7 | cal/mol*K | PHPMS | Hiraoka and Mori, 1990 | gas phase; M |
By formula: (Kr+ • 5Kr) + Kr = (Kr+ • 6Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.04 ± 0.15 | kcal/mol | PHPMS | Hiraoka and Mori, 1990 | gas phase; M |
Quantity | Value | Units | Method | Reference | Comment |
ΔrS° | 15.7 | cal/mol*K | PHPMS | Hiraoka and Mori, 1990 | gas phase; M |
By formula: NO- + Kr = (NO- • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 2.30 ± 0.90 | kcal/mol | N/A | Hendricks, de Clercq, et al., 2002 | gas phase; B |
ΔrH° | 2.50 ± 0.40 | kcal/mol | N/A | Bowen and Eaton, 1988 | gas phase; B |
By formula: Xe+ + Kr = (Xe+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 8.9 | kcal/mol | PI | Dehmer and Pratt, 1982 | gas phase; M |
ΔrH° | 8.5 | kcal/mol | PI | Ng, Tiedemann, et al., 1977 | gas phase; M |
By formula: H2O+ + Kr = (H2O+ • Kr)
Enthalpy of reaction
ΔrH° (kcal/mol) | T (K) | Method | Reference | Comment |
---|---|---|---|---|
7.6 (+2.3,-0.) | PD/KERD | Kim, Kuo, et al., 1990 | gas phase; M |
By formula: O2S+ + Kr = (O2S+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7. | kcal/mol | PDiss | Kim, Jarrold, et al., 1986 | gas phase; ΔrH<; M |
By formula: I- + Kr = (I- • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1.00 | kcal/mol | Ther | Zhao, Yourshaw, et al., 1994 | gas phase; B |
By formula: O2+ + Kr = (O2+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.6 | kcal/mol | PDiss | Jarrold, Misev, et al., 1984 | gas phase; M |
By formula: CO2+ + Kr = (CO2+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 17.1 | kcal/mol | PI | Jarrold, Illies, et al., 1985 | gas phase; M |
By formula: Fe+ + Kr = (Fe+ • Kr)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 7.2 ± 1.7 | kcal/mol | CIDT | Rodgers and Armentrout, 2000 | RCD |
Henry's Law data
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: Rolf Sander
Henry's Law constant (water solution)
kH(T) = k°H exp(d(ln(kH))/d(1/T) ((1/T) - 1/(298.15 K)))
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)
k°H (mol/(kg*bar)) | d(ln(kH))/d(1/T) (K) | Method | Reference |
---|---|---|---|
0.0025 | 1900. | L | N/A |
0.0024 | 1500. | M | N/A |
References
Go To: Top, Gas phase thermochemistry data, Reaction thermochemistry data, Henry's Law data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
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]
Chase, 1998
Chase, M.W., Jr.,
NIST-JANAF Themochemical Tables, Fourth Edition,
J. Phys. Chem. Ref. Data, Monograph 9, 1998, 1-1951. [all data]
Gatland, 1984
Gatland, I.R.,
Swarms of Ions and Electrons in Gases, W. Lindinger, T. D. Mark and F. Howorka, eds. (Springer, New York, 1984, 1984, 44. [all data]
Gislason, 1984
Gislason, E.A.,
Quoted in I. R. Gatland in Swarms of Ions and Electrons in Gases, W. Lindinger, T. D. Mark and F. Howorka, eds. (Springer, New York, 1984, 1984, 44. [all data]
Viehland, 1984
Viehland, L.A.,
Interaction Potentials for Li+ - Rare - Gas Systems,
Chem. Phys., 1984, 78, 2, 279, https://doi.org/10.1016/0301-0104(83)85114-3
. [all data]
Takebe, 1983
Takebe, M.,
The Generalized Mobility Curve for Alkali Ions in Rare Gases: Clustering Reactions and Mobility Curves,
J. Chem. Phys., 1983, 78, 12, 7223, https://doi.org/10.1063/1.444763
. [all data]
McMahon, Heinis, et al., 1988
McMahon, T.; Heinis, T.; Nicol, G.; Hovey, J.K.; Kebarle, P.,
Methyl Cation Affinities,
J. Am. Chem. Soc., 1988, 110, 23, 7591, https://doi.org/10.1021/ja00231a002
. [all data]
Foster, Williamson, et al., 1974
Foster, M.S.; Williamson, A.D.; Beauchamp, J.L.,
Photoionization mass spectrometry of trans-azomethane,
Int. J. Mass Spectrom. Ion Phys., 1974, 15, 429. [all data]
Hovey and McMahon, 1987
Hovey, J.K.; McMahon, T.B.,
Bond Strength in the Methylkryptonium Ion Determined from Ion Cyclotron Resonance Methyl Cation Exchange Equilibria,
J. Phys. Chem., 1987, 91, 17, 4560, https://doi.org/10.1021/j100301a028
. [all data]
McKnight and Sawina, 1973
McKnight, L.G.; Sawina, J.M.,
Equilibrium Constants and Binding Energies of Alkali Metal Ions with Inert Gases,
Bull. Am. Phys. Soc., 1973, 18, 804. [all data]
Yourshaw, Lenzer, et al., 1998
Yourshaw, I.; Lenzer, T.; Reiser, G.; Neumark, D.M.,
Zero electron kinetic energy spectroscopy of the KrBr-, XeBr-, and KrCl- anions,
J. Chem. Phys., 1998, 109, 13, 5247-5256, https://doi.org/10.1063/1.477141
. [all data]
Wada, Kikkawa, et al., 2007
Wada, A.; Kikkawa, A.; Sugiyama, T.; Hiraoka, K.,
Thermochemical Stabilities of the Gas-phase Cluster Ions of Halide Ions with Rare Gas Atoms,
Int. J. Mass Spectrom.., 2007, 267, 1-3, 284-287, https://doi.org/10.1016/j.ijms.2007.02.053
. [all data]
Gatland, 1984, 2
Gatland, I.R.,
Determination of Ion-Atom Potentials from Mobility Experiments.
in Swarms of Ions and Electrons In Gases, W. Lindinger, Ed., Springer-Verlag, NY,, 1984, 44. [all data]
Dehmer and Pratt, 1982
Dehmer, P.M.; Pratt, S.T.,
Photoionization of ArKr, ArXe, and KrXe and bond dissociation energies of the rare gas dimer ions,
J. Chem. Phys., 1982, 77, 4804. [all data]
Abouaf, Huber, et al., 1978
Abouaf, R.; Huber, B.A.; Cosby, P.C.; Saxon, R.P.; Moseley, J.T.,
Photofragment Spectroscopy and Potential Curves of Kr2+,
J. Chem. Phys., 1978, 68, 5, 2406, https://doi.org/10.1063/1.436011
. [all data]
Ng, Trevor, et al., 1977
Ng, C.Y.; Trevor, D.J.; Mahan, B.H.; Lee, Y.T.,
Photoionization Studies of the Kr2 and Ar2 van der Vaals Molecules,
J. Chem. Phys., 1977, 66, 2, 446, https://doi.org/10.1063/1.433989
. [all data]
Mittman and Weise, 1974
Mittman, H.U.; Weise, H.P.,
Scattering of Ions V. Elastic Scattering of the Symmetric Rare Gas Ion - Rare Gas Atom Systems,
Z. Naturforsch., 1974, A29, 400. [all data]
El-Shall, Schriver, et al., 1989
El-Shall, M.S.; Schriver, K.E.; Whetten, R.L.; Meot-Ner (Mautner), M.,
Ion/Molecule Clustering Thermochemistry by Laser Ionization High - Pressure Mass Spectrometry,
J. Phys. Chem., 1989, 93, 24, 7969, https://doi.org/10.1021/j100361a002
. [all data]
Hiraoka and Mori, 1990
Hiraoka, K.; Mori, T.,
Stability of Rare - Gas Cluster Ions,
J. Chem. Phys., 1990, 92, 7, 4408, https://doi.org/10.1063/1.457751
. [all data]
Hendricks, de Clercq, et al., 2002
Hendricks, J.H.; de Clercq, H.L.; Freidhoff, C.B.; Arnold, S.T.; Eaton, J.G.; Fancher, C.; Lyapustina, S.A.; S.,
Anion solvation at the microscopic level: Photoelectron spectroscopy of the solvated anion clusters, NO-(Y)(n), where Y=Ar, Kr, Xe, N2O, H2S, NH3, H2O, and C2H4(OH)(2),
J. Chem. Phys., 2002, 116, 18, 7926-7938, https://doi.org/10.1063/1.1457444
. [all data]
Bowen and Eaton, 1988
Bowen, K.H.; Eaton, J.G.,
Photodetachment Spectroscopy of Negative Cluster Ions,
in The Structure of Small Molecules and Ions, Ed. R. Naaman, Z. Vager, Plenum NY, 1988, 1988, p.147-169. [all data]
Ng, Tiedemann, et al., 1977
Ng, C.Y.; Tiedemann, P.W.; Mahan, B.H.; Lee, Y.T.,
Photoionization Studies of the Diatomic Internuclear Rare Gas Molecules XeKr, XeAr, and KrAr,
J. Chem. Phys., 1977, 66, 12, 5737, https://doi.org/10.1063/1.433848
. [all data]
Kim, Kuo, et al., 1990
Kim, H.S.; Kuo, C.H.; Bowers, M.T.,
Photodissociation Dynamics of Water Containing Clusters. I. Kr.H2O+,
J. Chem. Phys., 1990, 93, 8, 5594, https://doi.org/10.1063/1.459630
. [all data]
Kim, Jarrold, et al., 1986
Kim, H.S.; Jarrold, M.F.; Bowers, M.T.,
Photodissociation of Weakly Bound Ion-Molecule Clusters: Kr.SO2+,
J. Chem. Phys., 1986, 90, 16, 3584, https://doi.org/10.1021/j100407a024
. [all data]
Zhao, Yourshaw, et al., 1994
Zhao, Y.X.; Yourshaw, I.; Reiser, G.; Arnold, C.C.; Neumark, D.M.,
Study of the ArBr(-), ArI(-), and KrI(-) anions and the corresponding neutral van der Waals complexes by anion zero electron kinetic energy,
J. Chem. Phys., 1994, 101, 8, 6538, https://doi.org/10.1063/1.468500
. [all data]
Jarrold, Misev, et al., 1984
Jarrold, M.F.; Misev, L.; Bowers, M.T.,
Charge Transfer Half - Collisions: Photodissociation of the Kr.O2+ cluster Ion with Resolution of the Product Vibrational States,
J. Chem. Phys., 1984, 81, 10, 4369, https://doi.org/10.1063/1.447448
. [all data]
Jarrold, Illies, et al., 1985
Jarrold, M.F.; Illies, A.J.; Wagner-Redeker, W.; Bowers, M.T.,
Photodissociation of Weakly Bound Ion - Molecule Clusters: The Kr.CO2+ Cluster,
J. Phys. Chem., 1985, 89, 15, 3269, https://doi.org/10.1021/j100261a020
. [all data]
Rodgers and Armentrout, 2000
Rodgers, M.T.; Armentrout, P.B.,
Noncovalent Metal-Ligand Bond Energies as Studied by Threshold Collision-Induced Dissociation,
Mass Spectrom. Rev., 2000, 19, 4, 215, https://doi.org/10.1002/1098-2787(200007)19:4<215::AID-MAS2>3.0.CO;2-X
. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Reaction thermochemistry data, Henry's Law data, References
- Symbols used in this document:
S°gas,1 bar Entropy of gas at standard conditions (1 bar) T Temperature d(ln(kH))/d(1/T) Temperature dependence parameter for Henry's Law constant k°H Henry's Law constant at 298.15K ΔrG° Free energy of reaction at standard conditions ΔrH° Enthalpy of reaction at standard conditions ΔrS° Entropy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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