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State	Conformation	minimum conformation	conformer description	state description
1	1	yes	C2V	¹A₁
2	1	yes	C2V	³B₁

	hartrees
Energy at 0K	-5185.610434
Energy at 298.15K	-5185.615451
HF Energy	-5185.381098
Nuclear repulsion energy	326.356596

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	604	577	13.22
2	A₁	197	189	0.61
3	B₂	655	626	333.67

Atom	y (Å)	z (Å)
C1	0.000	0.996
Br2	1.552	-0.085
Br3	-1.552	-0.085

	C1	Br2	Br3
C1		1.8917	1.8917
Br2	1.8917		3.1036
Br3	1.8917	3.1036

All results from a given calculation for CBr₂ (dibromomethylene)

using model chemistry: B2PLYP=FULL/cc-pVTZ

States and conformations

State 1 (¹A₁)

	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 CBr2 (dibromomethylene)

using model chemistry: B2PLYP=FULL/cc-pVTZ

States and conformations

State 1 (1A1)

All results from a given calculation for CBr₂ (dibromomethylene)

State 1 (¹A₁)