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	hartrees
Energy at 0K	-2534.382347
Energy at 298.15K	-2534.381754
HF Energy	-2534.382347
Nuclear repulsion energy	319.315741

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	714	702	68.57
2	A₁	338	332	17.81
3	E	694	682	129.29
3	E	694	682	129.30
4	E	259	255	4.23
4	E	259	255	4.23

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.401
F2	0.000	1.503	-0.490
F3	1.302	-0.751	-0.490
F4	-1.302	-0.751	-0.490

	As1	F2	F3	F4
As1		1.7468	1.7468	1.7468
F2	1.7468		2.6031	2.6031
F3	1.7468	2.6031		2.6031
F4	1.7468	2.6031	2.6031

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	As1	F3	96.333		F2	As1	F4	96.333
F3	As1	F4	96.333

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

using model chemistry: B97D3/6-31+G**

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	1.166
2	F	-0.389
3	F	-0.389
4	F	-0.389

	x	y	z	Total
	0.000	0.000	2.598	2.598
CHELPG
AIM
ESP

	x	y	z
x	4.534	0.000	0.000
y	0.000	4.535	-0.000
z	0.000	-0.000	3.882

<r²>	93.466
(<r²>)^1/2	9.668

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

using model chemistry: B97D3/6-31+G**

States and conformations

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