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	hartrees
Energy at 0K	-2611.708289
Energy at 298.15K
HF Energy	-2611.369656
Nuclear repulsion energy	80.846579

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3199	3017	4.62
2	A₁	1418	1338	18.56
3	A₁	725	684	14.10
4	B₁	49	46	62.52
5	B₂	3350	3159	1.11
6	B₂	945	891	0.71

Atom	y (Å)	z (Å)
C1	0.000	-1.482
Br2	0.000	0.368
H3	0.949	-1.988
H4	-0.949	-1.988

	C1	Br2	H3	H4
C1		1.8496	1.0758	1.0758
Br2	1.8496		2.5398	2.5398
H3	1.0758	2.5398		1.8987
H4	1.0758	2.5398	1.8987

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	C1	H3	118.061		Br2	C1	H4	118.061
H3	C1	H4	123.878

All results from a given calculation for CH₂Br (bromomethyl radical)

using model chemistry: CCSD/6-311+G(3df,2p)

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

	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 CH2Br (bromomethyl radical)

using model chemistry: CCSD/6-311+G(3df,2p)

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

All results from a given calculation for CH₂Br (bromomethyl radical)