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	hartrees
Energy at 0K	-537.918459
Energy at 298.15K	-537.922131
HF Energy	-537.539503
Nuclear repulsion energy	94.485168

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3237	3008	4.95
2	A'	3188	2962	19.06
3	A'	1559	1449	0.86
4	A'	1525	1417	4.62
5	A'	1364	1267	25.80
6	A'	1122	1042	8.14
7	A'	713	663	104.45
8	A'	614	570	10.24
9	A'	319	297	11.41
10	A"	3350	3112	7.51
11	A"	3252	3021	5.45
12	A"	1331	1236	0.05
13	A"	1133	1053	2.45
14	A"	811	754	2.02
15	A"	209	194	2.07

Atom	x (Å)	y (Å)	z (Å)
C1	-1.476	0.805	0.000
C2	0.000	0.854	0.000
Cl3	0.711	-0.820	0.000
H4	-2.012	0.660	0.926
H5	-2.012	0.660	-0.926
H6	0.394	1.338	-0.887
H7	0.394	1.338	0.887

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.4773	2.7254	1.0795	1.0795	2.1381	2.1381
C2	1.4773		1.8191	2.2233	2.2233	1.0848	1.0848
Cl3	2.7254	1.8191		3.2349	3.2349	2.3553	2.3553
H4	1.0795	2.2233	3.2349		1.8522	3.0882	2.5004
H5	1.0795	2.2233	3.2349	1.8522		2.5004	3.0882
H6	2.1381	1.0848	2.3553	3.0882	2.5004		1.7736
H7	2.1381	1.0848	2.3553	2.5004	3.0882	1.7736

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	Cl3	111.116	C1	C2	H6	112.225
C1	C2	H7	112.225	C2	C1	H4	120.011
C2	C1	H5	120.011	Cl3	C2	H6	105.598
Cl3	C2	H7	105.598	H4	C1	H5	118.161

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

using model chemistry: CID/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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All results from a given calculation for CH2CH2Cl (2-chloroethyl radical)

using model chemistry: CID/6-311G*

States and conformations

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