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	hartrees
Energy at 0K	-637.369834
Energy at 298.15K	-637.372122
HF Energy	-637.369834
Nuclear repulsion energy	149.303085

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3293	3170	0.09
2	A'	3188	3069	2.59
3	A'	1731	1667	172.27
4	A'	1411	1359	3.75
5	A'	1206	1161	220.81
6	A'	966	930	41.31
7	A'	696	670	54.43
8	A'	436	420	0.96
9	A'	376	362	0.02
10	A"	847	815	76.00
11	A"	724	697	0.24
12	A"	536	516	1.17

Atom	x (Å)	y (Å)
C1	0.000	0.457
C2	-1.012	1.306
F3	1.271	0.841
Cl4	-0.148	-1.263
H5	-0.813	2.370
H6	-2.033	0.955

	C1	C2	F3	Cl4	H5	H6
C1		1.3204	1.3276	1.7267	2.0785	2.0933
C2	1.3204		2.3292	2.7099	1.0830	1.0802
F3	1.3276	2.3292		2.5383	2.5842	3.3060
Cl4	1.7267	2.7099	2.5383		3.6936	2.9106
H5	2.0785	1.0830	2.5842	3.6936		1.8690
H6	2.0933	1.0802	3.3060	2.9106	1.8690

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.399	C1	C2	H6	121.058
C2	C1	F3	123.189	C2	C1	Cl4	125.058
F3	C1	Cl4	111.753	H5	C2	H6	119.544

All results from a given calculation for C₂H₂ClF (1-chloro-1-fluoroethylene)

using model chemistry: B3PW91/6-311G*

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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Number	Element	Mulliken
1	C	0.182
2	C	-0.481
3	F	-0.179
4	Cl	-0.034
5	H	0.256
6	H	0.257

	x	y	z	Total
	-1.182	0.786	0.000	1.420
CHELPG
AIM
ESP

	x	y	z
x	4.694	-0.885	0.000
y	-0.885	6.813	0.000
z	0.000	0.000	2.379

<r²>	95.434
(<r²>)^1/2	9.769

All results from a given calculation for C2H2ClF (1-chloro-1-fluoroethylene)

using model chemistry: B3PW91/6-311G*

States and conformations

All results from a given calculation for C₂H₂ClF (1-chloro-1-fluoroethylene)