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	hartrees
Energy at 0K	-535.328592
Energy at 298.15K	-535.332141
HF Energy	-534.989446
Nuclear repulsion energy	93.912848

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3256	3256	6.57
2	A	3144	3144	9.31
3	A	3109	3109	11.98
4	A	3045	3045	11.04
5	A	1582	1582	4.17
6	A	1566	1566	9.50
7	A	1495	1495	7.39
8	A	1363	1363	36.36
9	A	1135	1135	4.44
10	A	1081	1081	2.51
11	A	1051	1051	18.62
12	A	714	714	27.82
13	A	427	427	30.95
14	A	338	338	5.93
15	A	167	167	0.55

Atom	x (Å)	y (Å)	z (Å)
C1	0.452	0.615	-0.078
C2	1.664	-0.273	0.011
Cl3	-1.123	-0.130	0.006
H4	0.471	1.660	0.199
H5	1.589	-1.097	-0.708
H6	2.563	0.312	-0.213
H7	1.774	-0.709	1.016

	C1	C2	Cl3	H4	H5	H6	H7
C1		1.5056	1.7438	1.0822	2.1497	2.1375	2.1671
C2	1.5056		2.7907	2.2801	1.0962	1.0958	1.1005
Cl3	1.7438	2.7907		2.4049	2.9665	3.7190	3.1217
H4	1.0822	2.2801	2.4049		3.1110	2.5233	2.8244
H5	2.1497	1.0962	2.9665	3.1110		1.7830	1.7767
H6	2.1375	1.0958	3.7190	2.5233	1.7830		1.7817
H7	2.1671	1.1005	3.1217	2.8244	1.7767	1.7817

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.440	C1	C2	H6	109.497
C1	C2	H7	111.579	C2	C1	Cl3	118.189
C2	C1	H4	122.711	H5	C2	H6	108.858
H5	C2	H7	107.961	H6	C2	H7	108.436

All results from a given calculation for CHClCH₃ (1-chloroethyl radical)

using model chemistry: MP3=FULL/3-21G*

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 CHClCH3 (1-chloroethyl radical)

using model chemistry: MP3=FULL/3-21G*

States and conformations

All results from a given calculation for CHClCH₃ (1-chloroethyl radical)