(Z)-1,2-Difluoroethylene
- Formula: C2H2F2
- Molecular weight: 64.0341
- IUPAC Standard InChIKey: WFLOTYSKFUPZQB-UPHRSURJSA-N
- CAS Registry Number: 1630-77-9
- 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: Ethene, 1,2-difluoro-, (Z)-
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Reaction thermochemistry data
Go To: Top, 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 by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
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Individual Reactions
C2H2F2 =
By formula: C2H2F2 = C2H2F2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | -1.08 ± 0.12 | kcal/mol | Eqk | Craig, Piper, et al., 1971 | gas phase |
= C2H2F2
By formula: C2H2F2 = C2H2F2
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔrH° | 0.93 | kcal/mol | Eqk | Craig and Entemann, 1961 | gas phase |
Vibrational and/or electronic energy levels
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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: Takehiko Shimanouchi
Symmetry: C2ν Symmetry Number σ = 2
Sym. | No | Approximate | Selected Freq. | Infrared | Raman | Comments | ||||
---|---|---|---|---|---|---|---|---|---|---|
Species | type of mode | Value | Rating | Value | Phase | Value | Phase | |||
a1 | 1 | CH str | 3135 | D | 3135 W | gas | SF(ν8) | |||
a1 | 2 | CC str | 1715 | C | 1715 S | gas | ||||
a1 | 3 | CH bend | 1266 | C | 1266 S | gas | ||||
a1 | 4 | CF str | 1014 | C | 1014 S | gas | ||||
a1 | 5 | CCF deform | 255 | D | 255 W | gas | ||||
a2 | 6 | CH bend | 866 | E | ia | CF ( )From product rule | ||||
a2 | 7 | Torsion | 482 | E | ia | CF ( )Calculated by assuming ?/? | ||||
b1 | 8 | CH str | 3135 | D | 3135 W | gas | SF(ν1) | |||
b1 | 9 | CH bend | 1376 | C | 1376 S | gas | ||||
b1 | 10 | CF str | 1127 | C | 1127 VS | gas | ||||
b1 | 11 | CCF deform | 768 | B | 768 S | gas | ||||
b2 | 12 | CH bend | 756 | B | 756 S | gas | ||||
Source: Shimanouchi, 1972
Notes
VS | Very strong |
S | Strong |
W | Weak |
ia | Inactive |
CF | Calculated frequency |
SF | Calculation shows that the frequency approximately equals that of the vibration indicated in the parentheses. |
B | 1~3 cm-1 uncertainty |
C | 3~6 cm-1 uncertainty |
D | 6~15 cm-1 uncertainty |
E | 15~30 cm-1 uncertainty |
References
Go To: Top, Reaction thermochemistry 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.
Craig, Piper, et al., 1971
Craig, N.C.; Piper, L.G.; Wheeler, V.L.,
Thermodynamics of cis-trans isomerizations. II. The 1-chloro-2-fluoroethylenes, 1,2-difluorocyclopropanes, and related molecules,
J. Phys. Chem., 1971, 75, 1453-1460. [all data]
Craig and Entemann, 1961
Craig, N.C.; Entemann, E.A.,
Thermodynamics of cis-trans isomerizations. The 1,2-difluoroethylenes,
J. Am. Chem. Soc., 1961, 83, 3047-3050. [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, Reaction thermochemistry data, Vibrational and/or electronic energy levels, References
- Symbols used in this document:
ΔrH° Enthalpy of reaction at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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