1,3,5,7,9-Pentaoxecane

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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.

Data compiled by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity Value Units Method Reference Comment
Δfgas-186.38 ± 0.32kcal/molCcbMansson, 1974 

Condensed 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.

Data compiled as indicated in comments:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Δfsolid-207.39 ± 0.29kcal/molCcbMansson, 1974ALS
Quantity Value Units Method Reference Comment
Δcsolid-604.44 ± 0.24kcal/molCcbMansson, 1974Corresponding Δfsolid = -207.39 kcal/mol (simple calculation by NIST; no Washburn corrections); ALS
Quantity Value Units Method Reference Comment
solid,1 bar44.86cal/mol*KN/AClegg and Melia, 1969Extrapolation below 180 K, 119.0 J/mol*K.; DH

Constant pressure heat capacity of solid

Cp,solid (cal/mol*K) Temperature (K) Reference Comment
40.97298.15Clegg and Melia, 1969T = 180 to 400 K.; DH

Phase change 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:
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DRB - Donald R. Burgess, Jr.
DH - Eugene S. Domalski and Elizabeth D. Hearing

Quantity Value Units Method Reference Comment
Tfus334.KN/AClegg and Melia, 1969, 2Crystal phase 1 phase; Uncertainty assigned by TRC = 2. K; TRC
Quantity Value Units Method Reference Comment
Δsub21.0 ± 0.1kcal/molCMånsson, Jönsson, et al., 1974AC
Δsub21.02 ± 0.13kcal/molCMansson, 1974ALS
Δsub21.0kcal/molN/AMansson, 1974DRB

Enthalpy of fusion

ΔfusH (kcal/mol) Temperature (K) Method Reference Comment
5.229334.DSCDomalski and Hearing, 1996AC
5.2342334.N/AClegg and Melia, 1969DH

Entropy of fusion

ΔfusS (cal/mol*K) Temperature (K) Reference Comment
15.7334.Clegg and Melia, 1969DH

In addition to the Thermodynamics Research Center (TRC) data available from this site, much more physical and chemical property data is available from the following TRC products:


References

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

Mansson, 1974
Mansson, M., Non-bonded oxygen-oxygen interactions in 2,4,10-trioxa-adamantane and 1,3,5,7,9-pentoxecane, Acta Chem. Scand., Ser. B, 1974, 28, 895-899. [all data]

Clegg and Melia, 1969
Clegg, G.A.; Melia, T.P., Heat capacity measurements on pentoxan, Makromol. Chem., 1969, 130, 258-260. [all data]

Clegg and Melia, 1969, 2
Clegg, G.A.; Melia, T.P., Heat capacity measurements on pentoxan, Makromol. Chem., 1969, 130, 258-60. [all data]

Månsson, Jönsson, et al., 1974
Månsson, Margret; Jönsson, Lennart; Norrgård, Håkan; Pettersson, Barbro; Guthenberg, Claes; Mannervik, Bengt, Non-bonded Oxygen-Oxygen Interactions in 2,4,10-Trioxa-adamantane and 1,3,5,7,9-Pentoxecane., Acta Chem. Scand., 1974, 28b, 895-899, https://doi.org/10.3891/acta.chem.scand.28b-0895 . [all data]

Domalski and Hearing, 1996
Domalski, Eugene S.; Hearing, Elizabeth D., Heat Capacities and Entropies of Organic Compounds in the Condensed Phase. Volume III, J. Phys. Chem. Ref. Data, 1996, 25, 1, 1, https://doi.org/10.1063/1.555985 . [all data]


Notes

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