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	hartrees
Energy at 0K	-2519.465697
Energy at 298.15K	-2519.465141
Nuclear repulsion energy	323.792355

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	786	772	37.12
2	A₁	315	309	17.74
3	E	782	768	62.60
3	E	782	768	62.58
4	E	247	243	3.51
4	E	247	243	3.51

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.395
F2	0.000	1.482	-0.483
F3	1.283	-0.741	-0.483
F4	-1.283	-0.741	-0.483

	As1	F2	F3	F4
As1		1.7227	1.7227	1.7227
F2	1.7227		2.5670	2.5670
F3	1.7227	2.5670		2.5670
F4	1.7227	2.5670	2.5670

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	As1	F3	96.325		F2	As1	F4	96.325
F3	As1	F4	96.325

All results from a given calculation for AsF₃ (Arsenic trifluoride)

using model chemistry: LSDA/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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Number	Element	Mulliken
1	As	0.663
2	F	-0.221
3	F	-0.221
4	F	-0.221

	x	y	z	Total
	0.000	0.000	1.743	1.743
CHELPG
AIM
ESP

	x	y	z
x	3.260	0.000	0.000
y	0.000	3.261	-0.001
z	0.000	-0.001	2.709

<r²>	90.385
(<r²>)^1/2	9.507

All results from a given calculation for AsF3 (Arsenic trifluoride)

using model chemistry: LSDA/3-21G*

States and conformations

All results from a given calculation for AsF₃ (Arsenic trifluoride)