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	hartrees
Energy at 0K	-637.314580
Energy at 298.15K	-637.316801
HF Energy	-637.314580
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3354	3354	0.11
2	A'	3235	3235	4.90
3	A'	1748	1748	155.30
4	A'	1445	1445	0.57
5	A'	1192	1192	192.51
6	A'	941	941	51.15
7	A'	661	661	44.88
8	A'	412	412	1.26
9	A'	357	357	1.13
10	A"	970	970	106.90
11	A"	721	721	0.27
12	A"	506	506	1.00

Atom	x (Å)	y (Å)
C1	0.000	0.478
C2	-0.994	1.361
F3	1.329	0.841
Cl4	-0.188	-1.298
H5	-0.772	2.421
H6	-2.025	1.036

	C1	C2	F3	Cl4	H5	H6
C1		1.3288	1.3774	1.7857	2.0907	2.1001
C2	1.3288		2.3798	2.7774	1.0833	1.0810
F3	1.3774	2.3798		2.6219	2.6290	3.3591
Cl4	1.7857	2.7774	2.6219		3.7641	2.9694
H5	2.0907	1.0833	2.6290	3.7641		1.8673
H6	2.1001	1.0810	3.3591	2.9694	1.8673

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.823	C1	C2	H6	120.921
C2	C1	F3	123.124	C2	C1	Cl4	125.554
F3	C1	Cl4	111.321	H5	C2	H6	119.256

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

using model chemistry: wB97X-D/SDD

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	0.165
2	C	-0.466
3	F	-0.196
4	Cl	-0.007
5	H	0.249
6	H	0.254

	x	y	z	Total
	-1.795	1.167	0.000	2.141
CHELPG
AIM
ESP

	x	y	z
x	4.311	-0.811	0.000
y	-0.811	6.255	0.000
z	0.000	0.000	1.800

<r²>	99.727
(<r²>)^1/2	9.986

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

using model chemistry: wB97X-D/SDD

States and conformations

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