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	hartrees
Energy at 0K	-2535.691657
Energy at 298.15K	-2535.691041
Nuclear repulsion energy	322.692869

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	720	696	73.29
2	A₁	327	317	22.96
3	E	687	664	123.71
3	E	687	664	123.71
4	E	252	243	4.69
4	E	252	243	4.68

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.398
F2	0.000	1.485	-0.487
F3	1.286	-0.743	-0.487
F4	-1.286	-0.743	-0.487

	As1	F2	F3	F4
As1		1.7290	1.7290	1.7290
F2	1.7290		2.5724	2.5724
F3	1.7290	2.5724		2.5724
F4	1.7290	2.5724	2.5724

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	As1	F3	96.134		F2	As1	F4	96.134
F3	As1	F4	96.134

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

using model chemistry: B3LYP/cc-pVTZ

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	1.016
2	F	-0.339
3	F	-0.339
4	F	-0.339

	x	y	z	Total
	0.000	0.000	2.501	2.501
CHELPG
AIM
ESP

	x	y	z
x	4.014	0.000	0.000
y	0.000	4.016	-0.001
z	0.000	-0.001	3.471

<r²>	91.654
(<r²>)^1/2	9.574

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

using model chemistry: B3LYP/cc-pVTZ

States and conformations

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