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	hartrees
Energy at 0K	-2611.812182
Energy at 298.15K
HF Energy	-2611.412750
Nuclear repulsion energy	81.222949

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3281	3281	4.36
2	A₁	1456	1456	21.54
3	A₁	745	745	16.06
4	B₁	38	38	65.12
5	B₂	3435	3435	1.25
6	B₂	967	967	0.89

Atom	y (Å)	z (Å)
C1	0.000	-1.476
Br2	0.000	0.366
H3	0.943	-1.978
H4	-0.943	-1.978

	C1	Br2	H3	H4
C1		1.8416	1.0689	1.0689
Br2	1.8416		2.5269	2.5269
H3	1.0689	2.5269		1.8866
H4	1.0689	2.5269	1.8866

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Br2	C1	H3	118.049		Br2	C1	H4	118.049
H3	C1	H4	123.902

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

using model chemistry: CID/Def2TZVPP

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: CID/Def2TZVPP

States and conformations

Conformer 1 (CS)

Conformer 2 (C2V)

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