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	hartrees
Energy at 0K	-2867.723310
Energy at 298.15K	-2867.727333
Nuclear repulsion energy	321.033272

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	730	659	10.07
2	A₁	581	525	0.07
3	A₁	271	244	37.02
4	B₁	245	221	35.89
5	B₂	636	575	308.12
6	B₂	371	335	9.84

Atom	y (Å)	z (Å)
Br1	0.000	0.324
F2	0.000	-1.452
F3	1.840	0.095
F4	-1.840	0.095

	Br1	F2	F3	F4
Br1		1.7758	1.8537	1.8537
F2	1.7758		2.4035	2.4035
F3	1.8537	2.4035		3.6791
F4	1.8537	2.4035	3.6791

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Br1	F3	82.909		F2	Br1	F4	82.909
F3	Br1	F4	165.819

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

using model chemistry: HF/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	1.556
2	F	-0.393
3	F	-0.581
4	F	-0.581

	x	y	z	Total
	0.000	0.000	2.468	2.468
CHELPG
AIM
ESP

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: HF/6-31G

States and conformations

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