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	hartrees
Energy at 0K	-375.904932
Energy at 298.15K	-375.906575
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3188	3144	7.16
2	A'	1787	1762	60.40
3	A'	1349	1330	113.87
4	A'	1257	1240	176.81
5	A'	1166	1150	110.86
6	A'	918	906	48.57
7	A'	602	593	2.61
8	A'	466	460	1.41
9	A'	217	214	3.30
10	A"	722	712	27.56
11	A"	524	517	1.24
12	A"	295	291	2.64

Atom	x (Å)	y (Å)
C1	0.000	0.438
C2	-0.705	-0.700
F3	1.328	0.512
F4	-0.578	1.640
F5	-0.080	-1.898
H6	-1.794	-0.721

	C1	C2	F3	F4	F5	H6
C1		1.3388	1.3297	1.3335	2.3374	2.1360
C2	1.3388		2.3665	2.3435	1.3508	1.0896
F3	1.3297	2.3665		2.2143	2.7912	3.3565
F4	1.3335	2.3435	2.2143		3.5727	2.6556
F5	2.3374	1.3508	2.7912	3.5727		2.0791
H6	2.1360	1.0896	3.3565	2.6556	2.0791

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	120.702	C1	C2	H6	122.854
C2	C1	F3	124.953	C2	C1	F4	122.551
F3	C1	F4	112.496	F5	C2	H6	116.444

All results from a given calculation for C₂HF₃ (Trifluoroethylene)

using model chemistry: PBEPBE/6-31G**

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	0.455
2	C	0.057
3	F	-0.201
4	F	-0.209
5	F	-0.233
6	H	0.130

	x	y	z	Total
	-1.004	0.213	0.000	1.027
CHELPG
AIM
ESP

	x	y	z
x	3.667	0.563	0.000
y	0.563	4.543	0.000
z	0.000	0.000	1.869

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2HF3 (Trifluoroethylene)

using model chemistry: PBEPBE/6-31G**

States and conformations

All results from a given calculation for C₂HF₃ (Trifluoroethylene)