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	hartrees
Energy at 0K	-27.319695
Energy at 298.15K	-27.322532
Nuclear repulsion energy	33.167260

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3469	3127	30.27
2	A'	3452	3111	2.24
3	A'	3358	3027	3.37
4	A'	1805	1627	51.66
5	A'	1528	1377	10.12
6	A'	1398	1260	32.81
7	A'	1125	1014	22.21
8	A'	712	642	54.27
9	A'	410	369	0.66
10	A"	1101	993	87.35
11	A"	1062	957	40.03
12	A"	678	611	20.87

Atom	x (Å)	y (Å)
C1	0.000	0.556
C2	1.321	0.307
Cl3	-1.223	-0.775
H4	-0.459	1.526
H5	1.725	-0.692
H6	2.011	1.140

	C1	C2	Cl3	H4	H5	H6
C1		1.3446	1.8076	1.0740	2.1290	2.0941
C2	1.3446		2.7654	2.1583	1.0774	1.0808
Cl3	1.8076	2.7654		2.4250	2.9499	3.7586
H4	1.0740	2.1583	2.4250		3.1134	2.5007
H5	2.1290	1.0774	2.9499	3.1134		1.8532
H6	2.0941	1.0808	3.7586	2.5007	1.8532

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	122.664	C1	C2	H6	119.000
C2	C1	Cl3	121.944	C2	C1	H4	125.973
Cl3	C1	H4	112.083	H5	C2	H6	118.336

All results from a given calculation for C₂H₃Cl (Ethene, chloro-)

using model chemistry: HF/CEP-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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Number	Element	Mulliken
1	C	-0.274
2	C	-0.242
3	Cl	-0.102
4	H	0.250
5	H	0.216
6	H	0.152

	x	y	z	Total
	1.920	1.651	0.000	2.532
CHELPG
AIM
ESP

	x	y	z
x	6.838	1.127	0.000
y	1.127	3.952	0.000
z	0.000	0.000	1.578

<r²>	50.149
(<r²>)^1/2	7.082

All results from a given calculation for C2H3Cl (Ethene, chloro-)

using model chemistry: HF/CEP-31G

States and conformations

All results from a given calculation for C₂H₃Cl (Ethene, chloro-)