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	hartrees
Energy at 0K	-376.392053
Energy at 298.15K
Nuclear repulsion energy	171.113748

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3165	3155	7.88
2	A'	1742	1737	67.51
3	A'	1314	1310	68.18
4	A'	1201	1198	202.98
5	A'	1119	1116	155.94
6	A'	897	894	57.29
7	A'	599	597	2.72
8	A'	466	465	1.35
9	A'	227	226	3.63
10	A"	735	733	32.16
11	A"	541	540	0.05
12	A"	294	293	3.27

Atom	x (Å)	y (Å)
C1	0.000	0.434
C2	-0.710	-0.694
F3	1.332	0.508
F4	-0.567	1.647
F5	-0.092	-1.903
H6	-1.793	-0.713

	C1	C2	F3	F4	F5	H6
C1		1.3328	1.3337	1.3390	2.3396	2.1290
C2	1.3328		2.3688	2.3454	1.3582	1.0836
F3	1.3337	2.3688		2.2145	2.8003	3.3550
F4	1.3390	2.3454	2.2145		3.5824	2.6600
F5	2.3396	1.3582	2.8003	3.5824		2.0758
H6	2.1290	1.0836	3.3550	2.6600	2.0758

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F5	120.786	C1	C2	H6	123.213
C2	C1	F3	125.332	C2	C1	F4	122.764
F3	C1	F4	111.904	F5	C2	H6	116.001

All results from a given calculation for C₂HF₃ (Trifluoroethylene)

using model chemistry: BLYP/cc-pVTZ

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	0.313
2	C	-0.005
3	F	-0.121
4	F	-0.131
5	F	-0.162
6	H	0.107

	x	y	z	Total
	-1.156	0.167	0.000	1.167
CHELPG
AIM
ESP

	x	y	z
x	4.108	0.544	0.000
y	0.544	5.007	0.000
z	0.000	0.000	2.476

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for C2HF3 (Trifluoroethylene)

using model chemistry: BLYP/cc-pVTZ

States and conformations

All results from a given calculation for C₂HF₃ (Trifluoroethylene)