Phosphine

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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
M - Michael M. Meot-Ner (Mautner) and Sharon G. Lias

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

H2P- + Hydrogen cation = Phosphine

By formula: H2P- + H+ = H3P

Quantity Value Units Method Reference Comment
ΔrH°1522. ± 6.3kJ/molD-EAErvin and Lineberger, 2005gas phase; High level calcns( Curtiss, Raghavachari, et al., 1991, Ricca and Bauschlicher, 1998) give DH ca. 84; B
ΔrH°1551. ± 8.8kJ/molG+TSBartmess, Scott, et al., 1979gas phase; 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
ΔrH°1524. ± 19.kJ/molEIAEHalmann and Platzner, 1969gas phase; B
ΔrH°<1534. ± 19.kJ/molEIAEEbinghaus, Kraus, et al., 1964gas phase; B
ΔrH°1529.7kJ/molN/ACheck, Faust, et al., 2001gas phase; MnF5-(q); ; ΔS(EA)=2.9; B
Quantity Value Units Method Reference Comment
ΔrG°1491. ± 6.7kJ/molH-TSErvin and Lineberger, 2005gas phase; High level calcns( Curtiss, Raghavachari, et al., 1991, Ricca and Bauschlicher, 1998) give DH ca. 84; B
ΔrG°1520. ± 8.4kJ/molIMREBartmess, Scott, et al., 1979gas phase; 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
ΔrG°1500.8kJ/molN/ACheck, Faust, et al., 2001gas phase; MnF5-(q); ; ΔS(EA)=2.9; B

(H4P+ • 4Phosphine) + Phosphine = (H4P+ • 5Phosphine)

By formula: (H4P+ • 4H3P) + H3P = (H4P+ • 5H3P)

Bond type: Hydrogen bond (positive ion to hydride)

Quantity Value Units Method Reference Comment
ΔrH°23.kJ/molDTLong and Franklin, 1974gas phase; Entropy change calculated or estimated; M
Quantity Value Units Method Reference Comment
ΔrS°55.2J/mol*KN/ALong and Franklin, 1974gas phase; Entropy change calculated or estimated; M

(H4P+ • 2Phosphine) + Phosphine = (H4P+ • 3Phosphine)

By formula: (H4P+ • 2H3P) + H3P = (H4P+ • 3H3P)

Bond type: Hydrogen bond (positive ion to hydride)

Quantity Value Units Method Reference Comment
ΔrH°31.kJ/molDTLong and Franklin, 1974gas phase; M
Quantity Value Units Method Reference Comment
ΔrS°77.0J/mol*KDTLong and Franklin, 1974gas phase; M

(H4P+ • 3Phosphine) + Phosphine = (H4P+ • 4Phosphine)

By formula: (H4P+ • 3H3P) + H3P = (H4P+ • 4H3P)

Bond type: Hydrogen bond (positive ion to hydride)

Quantity Value Units Method Reference Comment
ΔrH°27.kJ/molDTLong and Franklin, 1974gas phase; M
Quantity Value Units Method Reference Comment
ΔrS°62.8J/mol*KDTLong and Franklin, 1974gas phase; M

(H4P+ • Phosphine) + Phosphine = (H4P+ • 2Phosphine)

By formula: (H4P+ • H3P) + H3P = (H4P+ • 2H3P)

Bond type: Hydrogen bond (positive ion to hydride)

Quantity Value Units Method Reference Comment
ΔrH°38.kJ/molDTLong and Franklin, 1974gas phase; M
Quantity Value Units Method Reference Comment
ΔrS°93.3J/mol*KDTLong and Franklin, 1974gas phase; M

H4P+ + Phosphine = (H4P+ • Phosphine)

By formula: H4P+ + H3P = (H4P+ • H3P)

Bond type: Hydrogen bond (positive ion to hydride)

Quantity Value Units Method Reference Comment
ΔrH°48.1kJ/molDTLong and Franklin, 1974gas phase; M
Quantity Value Units Method Reference Comment
ΔrS°108.J/mol*KDTLong and Franklin, 1974gas phase; M

H6P3+ + Phosphine = (H6P3+ • Phosphine)

By formula: H6P3+ + H3P = (H6P3+ • H3P)

Quantity Value Units Method Reference Comment
ΔrH°45.2kJ/molDTLong and Franklin, 1974gas phase; M
Quantity Value Units Method Reference Comment
ΔrS°140.J/mol*KDTLong and Franklin, 1974gas phase; M

H5P2+ + Phosphine = (H5P2+ • Phosphine)

By formula: H5P2+ + H3P = (H5P2+ • H3P)

Quantity Value Units Method Reference Comment
ΔrH°40.kJ/molDTLong and Franklin, 1974gas phase; M
Quantity Value Units Method Reference Comment
ΔrS°84.J/mol*KDTLong and Franklin, 1974gas phase; M

IR Spectrum

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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: Coblentz Society, Inc.

Spectrum

A digitized version of this spectrum is not currently available.

Additional Data

View scan of original (hardcopy) spectrum.

Owner COBLENTZ SOCIETY
Collection (C) 2018 copyright by the U.S. Secretary of Commerce
on behalf of the United States of America. All rights reserved.
Source reference COBLENTZ NO. 10498
Date Not specified, most likely prior to 1982
Instrument Not specified, most likely a prism, grating, or hybrid spectrometer.
Data processing (NO SPECTRUM, ONLY SCANNED IMAGE IS AVAILABLE)

This IR spectrum is from the Coblentz Society's evaluated infrared reference spectra collection.


References

Go To: Top, Reaction thermochemistry data, IR Spectrum, Notes

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

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]

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]

Halmann and Platzner, 1969
Halmann, M.; Platzner, I., Negative Ions Produced by Electron Capture in Phosphine, J. Phys. Chem., 1969, 73, 12, 4376, https://doi.org/10.1021/j100846a062 . [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]

Long and Franklin, 1974
Long, J.W.; Franklin, J.L., Ion - Solvation Reactions of Phosphine, J. Am. Chem. Soc., 1974, 96, 8, 2320, https://doi.org/10.1021/ja00815a003 . [all data]


Notes

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