Tungsten hexafluoride

Data at NIST subscription sites:

NIST subscription sites provide data under the NIST Standard Reference Data Program, but require an annual fee to access. The purpose of the fee is to recover costs associated with the development of data collections included in such sites. Your institution may already be a subscriber. Follow the links above to find out more about the data in these sites and their terms of usage.


Gas phase thermochemistry data

Go To: Top, Gas phase ion energetics 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.

Quantity Value Units Method Reference Comment
Δfgas-411.501kcal/molReviewChase, 1998Data last reviewed in March, 1967
Quantity Value Units Method Reference Comment
gas,1 bar81.475cal/mol*KReviewChase, 1998Data last reviewed in March, 1967

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.

View table.

Temperature (K) 1000. to 6000.
A 36.03960
B 1.449870
C -0.390521
D 0.033201
E -0.733301
F -424.7651
G 120.5480
H -411.5000
ReferenceChase, 1998
Comment Data last reviewed in March, 1967

Gas phase ion energetics 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 as indicated in comments:
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
B - John E. Bartmess

Electron affinity determinations

EA (eV) Method Reference Comment
3.36 ± 0.20IMRBViggiano, Paulson, et al., 1985B
3.50 ± 0.10IMRBGeorge and Beauchamp, 1979EA: > F-, < Cl-; B
>5.10 ± 0.50NBIECompton, Reinhardt, et al., 1978B
3.70 ± 0.20NBIEDispert and Lacmann, 1977B
>4.90 ± 0.40NBIEMathur, Rothe, et al., 1977B
2.74061SIPage and Goode, 1969The Magnetron method, lacking mass analysis, is not considered reliable.; B

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
F3W+24.0 ± 0.5?EIHildenbrand, 1975LLK
F4W+19.5 ± 0.32FEIHildenbrand, 1975LLK
F5W+15.24 ± 0.10FEIHildenbrand, 1975LLK

Vibrational and/or electronic energy levels

Go To: Top, Gas phase thermochemistry data, 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.

Data compiled by: Takehiko Shimanouchi

Symmetry:   Oh     Symmetry Number σ = 24


 Sym.   No   Approximate   Selected Freq.  Infrared   Raman   Comments 
 Species   type of mode   Value   Rating   Value  Phase  Value  Phase

a1g 1 Sym str 771  B  ia 771.0 VS p gas
eg 2 Deg str 677  B  ia 677.2 W dp gas
f1u 3 Deg str 712  C 712 VS  ia
f1u 4 Deg deform 258  C 258 S  ia
f2g 5 Deg deform 320  C  ia 320 W dp gas
f2u 6 Deg deform 127  E  ia  ia OC(2ν6)

Source: Shimanouchi, 1972

Notes

VSVery strong
SStrong
WWeak
iaInactive
pPolarized
dpDepolarized
OCFrequency estimated from an overtone or a combination tone indicated in the parentheses.
B1~3 cm-1 uncertainty
C3~6 cm-1 uncertainty
E15~30 cm-1 uncertainty

References

Go To: Top, Gas phase thermochemistry data, Gas phase ion energetics 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]

Viggiano, Paulson, et al., 1985
Viggiano, A.A.; Paulson, J.F.; Dale, F.; Henchman, M.; Adams, N.G.; Smith, D., Ion chemistry and electon affinity of WF6, J. Phys. Chem., 1985, 89, 2264. [all data]

George and Beauchamp, 1979
George, P.M.; Beauchamp, J.L., The electron and fluoride affinites of tungsten hexafluoride by ICR spectroscopy, Chem. Phys., 1979, 36, 345. [all data]

Compton, Reinhardt, et al., 1978
Compton, R.N.; Reinhardt, P.W.; Cooper, C.D., Collisional ionization between fast alkali atoms and selected hexafluoride molecules, J. Chem. Phys., 1978, 68, 2023. [all data]

Dispert and Lacmann, 1977
Dispert, H.; Lacmann, K., Formation of WF6- and its dissociative products by collisional ionization, Chem. Phys. Lett., 1977, 45, 311. [all data]

Mathur, Rothe, et al., 1977
Mathur, B.P.; Rothe, R.W.; Reck, G.P., Ionization reactions of metal hexafluorides with alkali atoms and dimers, J. Chem. Phys., 1977, 67, 377. [all data]

Page and Goode, 1969
Page, F.M.; Goode, G.C., Negative Ions and the Magnetron., Wiley, NY, 1969. [all data]

Hildenbrand, 1975
Hildenbrand, D.L., Thermochemistry of the gaseous tungsten fluorides, Chem. Phys. Lett., 1975, 62, 3074. [all data]

Shimanouchi, 1972
Shimanouchi, T., Tables of Molecular Vibrational Frequencies Consolidated Volume I, National Bureau of Standards, 1972, 1-160. [all data]


Notes

Go To: Top, Gas phase thermochemistry data, Gas phase ion energetics data, Vibrational and/or electronic energy levels, References