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	hartrees
Energy at 0K	-2870.841163
Energy at 298.15K	-2870.844334
Nuclear repulsion energy	298.193356

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	491	487	12.68
2	A₁	435	431	2.78
3	A₁	106	105	11.33
4	B₁	190	188	18.13
5	B₂	522	518	104.08
6	B₂	208	206	2.11

Atom	y (Å)	z (Å)
Br1	0.000	0.300
F2	0.000	-1.624
F3	1.972	0.229
F4	-1.972	0.229

	Br1	F2	F3	F4
Br1		1.9231	1.9731	1.9731
F2	1.9231		2.7056	2.7056
F3	1.9731	2.7056		3.9437
F4	1.9731	2.7056	3.9437

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Br1	F3	87.953		F2	Br1	F4	87.953
F3	Br1	F4	175.906

All results from a given calculation for BrF₃ (Bromine trifluoride)

using model chemistry: BLYP/6-31G

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	Br	1.010
2	F	-0.287
3	F	-0.361
4	F	-0.361

	x	y	z	Total
	0.000	0.000	1.829	1.829
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for BrF3 (Bromine trifluoride)

using model chemistry: BLYP/6-31G

States and conformations

All results from a given calculation for BrF₃ (Bromine trifluoride)