Ethene, 1,1-difluoro-
- Formula: C2H2F2
- Molecular weight: 64.0341
- IUPAC Standard InChIKey: BQCIDUSAKPWEOX-UHFFFAOYSA-N
- CAS Registry Number: 75-38-7
- 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: Ethylene, 1,1-difluoro-; Genetron 1132a; Vinylidene difluoride; Vinylidene fluoride; 1,1-Difluoroethene; 1,1-Difluoroethylene; CH2=CF2; Halocarbon 1132A; NCI-C60208; UN 1959; VDF; FC 1132a
- 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:
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.
Phase change data
Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), 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:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 190. | K | N/A | PCR Inc., 1990 | BS |
Tboil | 190.2 | K | N/A | Weast and Grasselli, 1989 | BS |
Quantity | Value | Units | Method | Reference | Comment |
Tc | 302.74 | K | N/A | Tsiklis and Prokhorov, 1967 | TRC |
Tc | 303.25 | K | N/A | Mears, Stahl, et al., 1955 | Uncertainty assigned by TRC = 0.7 K; by sealed tube method; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Pc | 43.7534 | atm | N/A | Mears, Stahl, et al., 1955 | Uncertainty assigned by TRC = 1.0888 atm; from vapor pressure equation at Tc; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ρc | 6.40 | mol/l | N/A | Tsiklis and Prokhorov, 1967 | Vis in pVT apparatus, Khodeeva and Lebedeva Russ. J. Phys. Chem. 1966, 40, 1668.; TRC |
ρc | 6.51 | mol/l | N/A | Mears, Stahl, et al., 1955 | Uncertainty assigned by TRC = 0.23 mol/l; rectilinear diameters; TRC |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
3.15 | 233. | BG | Mears, Stahl, et al., 1955, 2 | AC |
2.3 | 273. | BG | Mears, Stahl, et al., 1955, 2 | AC |
Gas phase ion energetics data
Go To: Top, Phase change data, Mass spectrum (electron ionization), 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
L - Sharon G. Lias
Data compiled as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
View reactions leading to C2H2F2+ (ion structure unspecified)
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
IE (evaluated) | 10.29 ± 0.01 | eV | N/A | N/A | L |
Quantity | Value | Units | Method | Reference | Comment |
Proton affinity (review) | 175. | kcal/mol | N/A | Hunter and Lias, 1998 | HL |
Quantity | Value | Units | Method | Reference | Comment |
Gas basicity | 168.5 | kcal/mol | N/A | Hunter and Lias, 1998 | HL |
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
10.29 | PI | Frenking, Koch, et al., 1984 | LBLHLM |
10.29 ± 0.02 | PE | Bieri, Niessen, et al., 1981 | LLK |
10.29 | PE | Sell, Mintz, et al., 1978 | LLK |
10.29 ± 0.01 | PI | Reinke, Kraessig, et al., 1973 | LLK |
10.31 | PE | Lake and Thompson, 1970 | RDSH |
10.31 ± 0.02 | PI | Momigny, 1963 | RDSH |
10.30 | PI | Bralsford, Harris, et al., 1960 | RDSH |
10.70 ± 0.02 | PE | Bieri, Niessen, et al., 1981 | Vertical value; LLK |
10.69 ± 0.02 | PE | Sell and Kuppermann, 1979 | Vertical value; LLK |
Appearance energy determinations
Ion | AE (eV) | Other Products | Method | Reference | Comment |
---|---|---|---|---|---|
CF+ | 14.92 | CH2F | PI | Frenking, Koch, et al., 1984 | LBLHLM |
CF+ | 14.92 ± 0.02 | CH2F | PI | Reinke, Kraessig, et al., 1973 | LLK |
CF+ | 15.23 | ? | EI | Lifshitz and Long, 1963 | RDSH |
CH2+ | 16.99 ± 0.02 | CF2 | PI | Reinke, Kraessig, et al., 1973 | LLK |
CH2+ | 17.2 ± 0.1 | CF2 | EI | Syrvatka, Bel'ferman, et al., 1971 | LLK |
CH2+ | 17.8 | CF2 | EI | Lifshitz and Long, 1963 | RDSH |
CH2F+ | 14.84 | CF | PI | Frenking, Koch, et al., 1984 | LBLHLM |
CH2F+ | 14.84 ± 0.02 | CF | PI | Reinke, Kraessig, et al., 1973 | LLK |
CH2F+ | 15.08 | CF | EI | Lifshitz and Long, 1963 | RDSH |
C2HF+ | 14.18 | HF | PI | Frenking, Koch, et al., 1984 | LBLHLM |
C2HF+ | 14.18 ± 0.03 | HF | PI | Reinke, Kraessig, et al., 1973 | LLK |
C2HF+ | 14.44 | HF | EI | Lifshitz and Long, 1963 | RDSH |
C2HF2+ | 15.80 ± 0.04 | H | PI | Reinke, Kraessig, et al., 1973 | LLK |
C2HF2+ | 16.67 | H | EI | Lifshitz and Long, 1963 | RDSH |
C2H2+ | 19.08 ± 0.03 | 2F | PI | Reinke, Kraessig, et al., 1973 | LLK |
C2H2+ | 19.8 ± 0.1 | ? | EI | Lifshitz and Long, 1963 | RDSH |
C2H2F+ | 14.37 | F | PI | Frenking, Koch, et al., 1984 | LBLHLM |
C2H2F+ | 14.37 ± 0.02 | F | PI | Reinke, Kraessig, et al., 1973 | LLK |
C2H2F+ | 14.80 | F | EI | Lifshitz and Long, 1963 | RDSH |
Mass spectrum (electron ionization)
Go To: Top, Phase change 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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
Notice: This spectrum may be better viewed with a Javascript and HTML 5 enabled browser.
Additional Data
View image of digitized spectrum (can be printed in landscape orientation).
Due to licensing restrictions, this spectrum cannot be downloaded.
Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
NIST MS number | 19017 |
References
Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
PCR Inc., 1990
PCR Inc.,
Research Chemicals Catalog 1990-1991, PCR Inc., Gainesville, FL, 1990, 1. [all data]
Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]
Tsiklis and Prokhorov, 1967
Tsiklis, D.S.; Prokhorov, V.M.,
Phase equilibria in systems containing fluorine compounds,
Zh. Fiz. Khim., 1967, 41, 2195-9. [all data]
Mears, Stahl, et al., 1955
Mears, W.H.; Stahl, R.F.; Orfeo, S.R.; Shair, R.C.; Kells, L.F.; Thompson, W.; McCann, H.,
Thermodynamic Properties of Halogenated Ethanes and Ethylenes,
Ind. Eng. Chem., 1955, 47, 1449. [all data]
Mears, Stahl, et al., 1955, 2
Mears, Whitney H.; Stahl, Richard F.; Orfeo, S. Robert; Shair, Robert C.; Kells, Lyman F.; Thompson, Walter; McCann, Harold,
Thermodynamic Properties of Halogenated Ethanes and Ethylenes,
Ind. Eng. Chem., 1955, 47, 7, 1449-1454, https://doi.org/10.1021/ie50547a052
. [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]
Frenking, Koch, et al., 1984
Frenking, G.; Koch, W.; Schaale, M.; Baumgartel, H.,
The unimolecular decay of difluoroethene cations. An experimental and quantum-chemical study,
Int. J. Mass Spectrom. Ion Phys., 1984, 61, 305. [all data]
Bieri, Niessen, et al., 1981
Bieri, G.; Niessen, W.V.; Asbrink, L.; Svensson, A.,
The He(II) photoelectron spectra of the fluorosubstituted ethylenes and their analysis by the green's function method,
Chem. Phys., 1981, 60, 61. [all data]
Sell, Mintz, et al., 1978
Sell, J.A.; Mintz, D.M.; Kupperman, A.,
Photoelectron angular distributions of carbon-carbon π electrons in ethylene, benzene, and their fluorinated derivatives,
Chem. Phys. Lett., 1978, 58, 601. [all data]
Reinke, Kraessig, et al., 1973
Reinke, D.; Kraessig, R.; Baumgartel, H.,
Photoreactions of small organic molecules,
Z. Naturforsch. A:, 1973, 28, 1021. [all data]
Lake and Thompson, 1970
Lake, R.F.; Thompson, H.,
Photoelectron spectra of halogenated ethylenes,
Proc. Roy. Soc. (London), 1970, A315, 323. [all data]
Momigny, 1963
Momigny, J.,
Ionization potentials and the structures of the photo-ionization yield curves of ethylene and its halogeno derivatives,
Nature, 1963, 199, 1179. [all data]
Bralsford, Harris, et al., 1960
Bralsford, R.; Harris, P.V.; Price, W.C.,
The effect of fluorine on the electronic spectra and ionization potentials of molecules,
Proc. Roy. Soc. (London), 1960, A258, 459. [all data]
Sell and Kuppermann, 1979
Sell, J.A.; Kuppermann, A.,
Variable angle photoelectron spectroscopy of the fluoroethylenes,
J. Chem. Phys., 1979, 71, 4703. [all data]
Lifshitz and Long, 1963
Lifshitz, C.; Long, F.A.,
Appearance potentials and mass spectra of fluorinated ethylenes. I. Decomposition mechanisms and their energetics,
J. Phys. Chem., 1963, 67, 2463. [all data]
Syrvatka, Bel'ferman, et al., 1971
Syrvatka, B.G.; Bel'ferman, A.L.; Gil'burd, M.M.; Moin, F.B.,
Determination of the dissociation energy of the double bond in some fluorochloro-substituted ethylenes and their ions by electron bombardment,
J. Org. Chem. USSR, 1971, 7, 8, In original 9. [all data]
Notes
Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), References
- Symbols used in this document:
AE Appearance energy IE (evaluated) Recommended ionization energy Pc Critical pressure Tboil Boiling point Tc Critical temperature ΔvapH Enthalpy of vaporization ρc Critical density - 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.