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	hartrees
Energy at 0K	-2611.705533
Energy at 298.15K
HF Energy	-2611.369683
Nuclear repulsion energy	80.926048

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3231	3231	3.86
2	A₁	1427	1427	18.88
3	A₁	731	731	15.05
4	B₁	63i	63i	63.24
5	B₂	3385	3385	1.86
6	B₂	951	951	0.79

Atom	y (Å)	z (Å)
C1	0.000	-1.481
Br2	0.000	0.367
H3	0.947	-1.986
H4	-0.947	-1.986

	C1	Br2	H3	H4
C1		1.8481	1.0737	1.0737
Br2	1.8481		2.5368	2.5368
H3	1.0737	2.5368		1.8949
H4	1.0737	2.5368	1.8949

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	C1	H3	118.062		Br2	C1	H4	118.062
H3	C1	H4	123.876

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

using model chemistry: MP3/6-311+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: MP3/6-311+G(3df,2p)

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

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