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	hartrees
Energy at 0K	-537.937728
Energy at 298.15K	-537.941381
HF Energy	-537.506172
Nuclear repulsion energy	94.166248

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3235	3045	5.55
2	A'	3171	2986	18.39
3	A'	1554	1463	0.61
4	A'	1521	1432	1.14
5	A'	1327	1249	25.52
6	A'	1115	1050	7.33
7	A'	686	646	94.33
8	A'	603	568	2.28
9	A'	315	296	10.40
10	A"	3348	3151	8.26
11	A"	3238	3049	6.49
12	A"	1307	1230	0.05
13	A"	1109	1044	1.12
14	A"	799	752	0.90
15	A"	223	210	1.61

Atom	x (Å)	y (Å)	z (Å)
C1	-1.475	0.817	0.000
C2	0.000	0.859	0.000
Cl3	0.710	-0.828	0.000
H4	-2.011	0.671	0.926
H5	-2.011	0.671	-0.926
H6	0.399	1.342	-0.888
H7	0.399	1.342	0.888

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4760	2.7360	1.0800	1.0800	2.1392	2.1392
C2	1.4760		1.8312	2.2223	2.2223	1.0863	1.0863
Cl3	2.7360	1.8312		3.2424	3.2424	2.3656	2.3656
H4	1.0800	2.2223	3.2424		1.8526	3.0902	2.5020
H5	1.0800	2.2223	3.2424	1.8526		2.5020	3.0902
H6	2.1392	1.0863	2.3656	3.0902	2.5020		1.7754
H7	2.1392	1.0863	2.3656	2.5020	3.0902	1.7754

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	111.188	C1	C2	H6	112.317
C1	C2	H7	112.317	C2	C1	H4	119.985
C2	C1	H5	119.985	Cl3	C2	H6	105.491
Cl3	C2	H7	105.491	H4	C1	H5	118.109

All results from a given calculation for CH₂CH₂Cl (2-chloroethyl radical)

using model chemistry: QCISD/6-31G**

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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All results from a given calculation for CH2CH2Cl (2-chloroethyl radical)

using model chemistry: QCISD/6-31G**

States and conformations

All results from a given calculation for CH₂CH₂Cl (2-chloroethyl radical)