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	hartrees
Energy at 0K	-637.393404
Energy at 298.15K	-637.395705
HF Energy	-637.393404
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3325	3183	0.30
2	A'	3210	3073	4.24
3	A'	1749	1675	167.04
4	A'	1395	1335	1.15
5	A'	1196	1145	192.17
6	A'	955	914	44.37
7	A'	704	674	46.29
8	A'	433	414	1.21
9	A'	375	359	0.03
10	A"	879	841	59.82
11	A"	713	682	0.05
12	A"	532	510	2.51

Atom	x (Å)	y (Å)
C1	0.000	0.458
C2	-1.001	1.324
F3	1.281	0.828
Cl4	-0.159	-1.265
H5	-0.788	2.390
H6	-2.028	0.973

	C1	C2	F3	Cl4	H5	H6
C1		1.3237	1.3335	1.7299	2.0870	2.0924
C2	1.3237		2.3352	2.7221	1.0875	1.0852
F3	1.3335	2.3352		2.5408	2.5923	3.3121
Cl4	1.7299	2.7221	2.5408		3.7088	2.9154
H5	2.0870	1.0875	2.5923	3.7088		1.8832
H6	2.0924	1.0852	3.3121	2.9154	1.8832

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	119.565	C1	C2	H6	120.266
C2	C1	F3	122.996	C2	C1	Cl4	125.587
F3	C1	Cl4	111.417	H5	C2	H6	120.168

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

using model chemistry: wB97X-D/aug-cc-pVDZ

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	0.376
2	C	0.761
3	F	-0.433
4	Cl	-0.077
5	H	-0.321
6	H	-0.307

	x	y	z	Total
	-1.203	0.783	0.000	1.436
CHELPG
AIM
ESP

	x	y	z
x	6.045	-0.882	0.000
y	-0.882	7.741	0.000
z	0.000	0.000	4.410

<r²>	95.840
(<r²>)^1/2	9.790

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

using model chemistry: wB97X-D/aug-cc-pVDZ

States and conformations

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