Phosphino radical
- Formula: H2P
- Molecular weight: 32.98964
- IUPAC Standard InChIKey: FVZVCSNXTFCBQU-UHFFFAOYSA-N
- CAS Registry Number: 13765-43-0
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - 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:
- Options:
Gas phase thermochemistry data
Go To: Top, Gas phase ion energetics 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 |
---|---|---|---|---|---|
ΔfH°gas | 125.94 | kJ/mol | Review | Chase, 1998 | Data last reviewed in March, 1963 |
Quantity | Value | Units | Method | Reference | Comment |
S°gas,1 bar | 212.66 | J/mol*K | Review | Chase, 1998 | Data last reviewed in March, 1963 |
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 (J/mol*K)
H° = standard enthalpy (kJ/mol)
S° = standard entropy (J/mol*K)
t = temperature (K) / 1000.
View plot Requires a JavaScript / HTML 5 canvas capable browser.
Temperature (K) | 298. to 1300. | 1300. to 6000. |
---|---|---|
A | 25.65240 | 53.33303 |
B | 26.34046 | 2.504020 |
C | -2.484837 | -0.475616 |
D | -2.373633 | 0.031360 |
E | 0.139285 | -8.976605 |
F | 117.6135 | 91.56433 |
G | 236.7600 | 254.3244 |
H | 125.9380 | 125.9380 |
Reference | Chase, 1998 | Chase, 1998 |
Comment | Data last reviewed in March, 1963 | Data last reviewed in March, 1963 |
Gas phase ion energetics data
Go To: Top, Gas phase 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 evaluated as indicated in comments:
HL - Edward P. Hunter and 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
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
View reactions leading to H2P+ (ion structure unspecified)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Proton affinity (review) | 709.2 | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 675.7 | kJ/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
ΔfH°(+) ion | 1090. ± 4. | kJ/mol | N/A | N/A |
Electron affinity determinations
EA (eV) | Method | Reference | Comment |
---|---|---|---|
1.2630 ± 0.0060 | LPES | Ervin and Lineberger, 2005 | High level calcns( Curtiss, Raghavachari, et al., 1991, Ricca and Bauschlicher, 1998) give DH ca. 84; B |
1.271 ± 0.010 | LPES | Zittel and Lineberger, 1976 | B |
0.96 ± 0.11 | D-EA | Bartmess, Scott, et al., 1979 | The D-EA cycle does not close by 7 kcal/mol. The reason for this discrepancy is not known; value altered from reference due to change in acidity scale; B |
1.250 ± 0.030 | PD | Smyth and Brauman, 1972 | B |
1.300 ± 0.030 | LPD | Smyth, McIver, et al., 1971 | B |
>1.14 ± 0.21 | D-EA | Ebinghaus, Kraus, et al., 1964 | B |
1.22443 | N/A | Check, Faust, et al., 2001 | MnF5-(q); ; ΔS(EA)=2.9; B |
1.60014 | SI | Page and Goode, 1969 | The Magnetron method, lacking mass analysis, is not considered reliable.; B |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
9.824 ± 0.002 | PI | Berkowitz, Curtiss, et al., 1986 | T = 0K; LBLHLM |
9.84 ± 0.01 | PE | Dyke, Jonathan, et al., 1982 | T = 0K; LBLHLM |
9.96 | EI | McAllister and Lossing, 1969 | RDSH |
9.83 ± 0.02 | EI | McAllister and Lossing, 1969 | RDSH |
De-protonation reactions
HP- + =
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 1547. ± 34. | kJ/mol | D-EA | Ervin and Lineberger, 2005 | gas phase; B |
References
Go To: Top, Gas phase thermochemistry data, Gas phase ion energetics data, 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]
Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G.,
Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update,
J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018
. [all data]
Ervin and Lineberger, 2005
Ervin, K.M.; Lineberger, W.C.,
Photoelectron spectroscopy of phosphorus hydride anions,
J. Chem. Phys., 2005, 122, 19, 194303, https://doi.org/10.1063/1.1881153
. [all data]
Curtiss, Raghavachari, et al., 1991
Curtiss, L.A.; Raghavachari, K.; Trucks, G.W.; Pople, J.A.,
Gaussian-2 Theory for Molecular Energies of First- and Second-row Compounds,
J. Chem. Phys., 1991, 94, 11, 7221, https://doi.org/10.1063/1.460205
. [all data]
Ricca and Bauschlicher, 1998
Ricca, A.; Bauschlicher, C.W., Jr.,
Accurate Heats of Formation for PHn, PHn+, and PHn-,
Chem. Phys. Lett., 1998, 285, 5-6, 455, https://doi.org/10.1016/S0009-2614(97)01468-1
. [all data]
Zittel and Lineberger, 1976
Zittel, P.F.; Lineberger, W.C.,
Laser photoelectron spectrometry of PO-, PH-, and PH2-,
J. Chem. Phys., 1976, 65, 1236. [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]
Smyth and Brauman, 1972
Smyth, K.C.; Brauman, J.I.,
Photodetachment of electrons from phosphide ion the electron affinity of PH2-,
J. Chem. Phys., 1972, 56, 1132. [all data]
Smyth, McIver, et al., 1971
Smyth, K.C.; McIver, R.T.; Brauman, J.I.; Wallace, R.W.,
Photodetachment of negative ions using a continuously tunable laser and an ICR spectrometer,
J. Chem. Phys., 1971, 54, 2758. [all data]
Ebinghaus, Kraus, et al., 1964
Ebinghaus, H.; Kraus, K.; Neuert, H.; Muller-Duysing, W.,
Negative Ionen durch Elecktronenresonanzeinfang in PH3, AsH3, und SiH4,
Z. Naturfor., 1964, 19A, 732. [all data]
Check, Faust, et al., 2001
Check, C.E.; Faust, T.O.; Bailey, J.M.; Wright, B.J.; Gilbert, T.M.; Sunderlin, L.S.,
Addition of Polarization and Diffuse Functions to the LANL2DZ Basis Set for P-Block Elements,
J. Phys. Chem. A,, 2001, 105, 34, 8111, https://doi.org/10.1021/jp011945l
. [all data]
Page and Goode, 1969
Page, F.M.; Goode, G.C.,
Negative Ions and the Magnetron., Wiley, NY, 1969. [all data]
Berkowitz, Curtiss, et al., 1986
Berkowitz, J.; Curtiss, L.; Gibson, S.; Greene, J.; Hillhouse, G.; Pople, J.,
Photoionization mass spectrometric study and Ab initio calculation of ionization and bonding in P-H compounds. Heats of formation, bond energies, and the 3B1-1A1 separation in PH2+,
J. Chem. Phys., 1986, 84, 375. [all data]
Dyke, Jonathan, et al., 1982
Dyke, J.M.; Jonathan, N.; Morris, A.,
Recent progress in the study of transient species with vacuum ultraviolet photoelectron spectroscopy,
Int. Rev. Phys. Chem., 1982, 2, 3. [all data]
McAllister and Lossing, 1969
McAllister, T.; Lossing, F.P.,
Free radicals by mass spectrometry. XLI. Ionization potential and heat of formation of PH2 radical,
J. Phys. Chem., 1969, 73, 2996. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Gas phase ion energetics data, References
- Symbols used in this document:
EA Electron affinity 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
- The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
- Customer support for NIST Standard Reference Data products.