2',3',4',5',6'-Pentafluoroacetophenone
- Formula: C8H3F5O
- Molecular weight: 210.1008
- IUPAC Standard InChIKey: FBGHCYZBCMDEOX-UHFFFAOYSA-N
- CAS Registry Number: 652-29-9
- 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. - Other names: 2,3,4,5,6-Pentafluoroacetophenone; Pentafluoroacetophenone; Ethanone, 1-(pentafluorophenyl)-; Acetophenone, 2',3',4',5',6'-pentafluoro-
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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 by: John E. Bartmess
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Individual Reactions
By formula: F- + C8H3F5O = (F- • C8H3F5O)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 157. ± 8.4 | kJ/mol | IMRE | Dillow and Kebarle, 1988 | gas phase; Anchored to C6F6..F- in Hiraoka, Mizuse, et al., 1987 |
Quantity | Value | Units | Method | Reference | Comment |
ΔrG° | 121. ± 8.4 | kJ/mol | IMRE | Dillow and Kebarle, 1988 | gas phase; Anchored to C6F6..F- in Hiraoka, Mizuse, et al., 1987 |
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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Gas Phase Spectrum
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Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.
Additional Data
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Owner | SRD/NIST Collection (C) 2018 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | EPA-IR VAPOR PHASE LIBRARY |
State | gas |
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.
Dillow and Kebarle, 1988
Dillow, G.W.; Kebarle, P.,
Fluoride Affinities of Perfluorobenzenes C6F5X. Meisenheimer Complexes in the Gas Phase and Solution,
J. Am. Chem. Soc., 1988, 110, 15, 4877, https://doi.org/10.1021/ja00223a001
. [all data]
Hiraoka, Mizuse, et al., 1987
Hiraoka, K.; Mizuse, S.; Yamabe, S.,
A Determination of the Stability and Structure of F-(C6H6) and F-(C6F6) Clusters,
J. Chem. Phys., 1987, 86, 7, 4102, https://doi.org/10.1063/1.451920
. [all data]
Notes
Go To: Top, Reaction thermochemistry data, IR Spectrum, References
- Symbols used in this document:
ΔrG° Free energy of reaction at standard conditions ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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