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	hartrees
Energy at 0K	-7184.768645
Energy at 298.15K
HF Energy	-7184.351618
Nuclear repulsion energy	432.322404

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	625	606	2.39
2	A₁	545	529	0.12
3	A₁	227	220	29.58
4	B₁	190	184	21.21
5	B₂	607	589	72.10
6	B₂	300	291	10.29

Atom	y (Å)	z (Å)
I1	0.000	0.301
F2	0.000	-1.632
F3	1.936	-0.070
F4	-1.936	-0.070

	I1	F2	F3	F4
I1		1.9324	1.9708	1.9708
F2	1.9324		2.4871	2.4871
F3	1.9708	2.4871		3.8713
F4	1.9708	2.4871	3.8713

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	I1	F3	79.158		F2	I1	F4	79.158
F3	I1	F4	158.316

All results from a given calculation for IF₃ (iodone trifluoride)

using model chemistry: QCISD/3-21G

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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All results from a given calculation for IF3 (iodone trifluoride)

using model chemistry: QCISD/3-21G

States and conformations

All results from a given calculation for IF₃ (iodone trifluoride)