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	hartrees
Energy at 0K	-376.249189
Energy at 298.15K
Nuclear repulsion energy	171.676864

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3157	3140	7.34
2	A'	1757	1748	58.54
3	A'	1329	1321	78.72
4	A'	1239	1232	177.55
5	A'	1147	1141	122.87
6	A'	909	904	46.16
7	A'	603	600	2.75
8	A'	470	467	1.26
9	A'	220	219	3.50
10	A"	725	721	25.20
11	A"	539	536	1.14
12	A"	295	294	2.43

Atom	x (Å)	y (Å)
C1	0.000	0.437
C2	-0.704	-0.699
F3	1.324	0.514
F4	-0.571	1.639
F5	-0.086	-1.899
H6	-1.791	-0.720

	C1	C2	F3	F4	F5	H6
C1		1.3368	1.3267	1.3304	2.3375	2.1323
C2	1.3368		2.3635	2.3422	1.3490	1.0874
F3	1.3267	2.3635		2.2038	2.7948	3.3510
F4	1.3304	2.3422	2.2038		3.5708	2.6560
F5	2.3375	1.3490	2.7948	3.5708		2.0728
H6	2.1323	1.0874	3.3510	2.6560	2.0728

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	120.984	C1	C2	H6	122.848
C2	C1	F3	125.084	C2	C1	F4	122.840
F3	C1	F4	112.075	F5	C2	H6	116.168

All results from a given calculation for C₂HF₃ (Trifluoroethylene)

using model chemistry: BLYP/6-31G(2df,p)

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	C	0.166
2	C	-0.238
3	F	-0.000
4	F	-0.011
5	F	-0.035
6	H	0.119

	x	y	z	Total
	-0.998	0.194	0.000	1.016
CHELPG
AIM
ESP

	x	y	z
x	3.965	0.557	0.000
y	0.557	4.849	0.000
z	0.000	0.000	2.277

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2HF3 (Trifluoroethylene)

using model chemistry: BLYP/6-31G(2df,p)

States and conformations

All results from a given calculation for C₂HF₃ (Trifluoroethylene)