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	hartrees
Energy at 0K	-5183.224767
Energy at 298.15K
HF Energy	-5183.224767
Nuclear repulsion energy	336.149813

Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
A'	3376	3376	1.17
A'	696	696	14.91
A'	577	577	7.49
A'	194	194	0.07
A"	1291	1291	87.02
A"	811	811	110.97

Atom	x (Å)	y (Å)	z (Å)
C1	0.007	0.849	0.000
H2	-0.562	1.755	0.000
Br3	0.007	-0.098	1.620
Br4	0.007	-0.098	-1.620

	C1	H2	Br3	Br4
C1		1.0703	1.8763	1.8763
H2	1.0703		2.5262	2.5262
Br3	1.8763	2.5262		3.2401
Br4	1.8763	2.5262	3.2401

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	Br3	115.290		H2	C1	Br4	115.290
Br3	C1	Br4	119.411

All results from a given calculation for CHBr₂ (dibromomethyl radical)

using model chemistry: ROHF/TZVP

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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Number	Element	Mulliken
1	C	-0.033
2	H	0.155
3	Br	-0.061
4	Br	-0.061

	x	y	z	Total
	-0.490	1.015	0.000	1.127
CHELPG
AIM
ESP

<r²>	218.638
(<r²>)^1/2	14.786

All results from a given calculation for CHBr2 (dibromomethyl radical)

using model chemistry: ROHF/TZVP

States and conformations

All results from a given calculation for CHBr₂ (dibromomethyl radical)