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	hartrees
Energy at 0K	-3599.114279
Energy at 298.15K	-3599.112469
HF Energy	-3599.114279
Nuclear repulsion energy	516.766707

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	365	354	17.29
2	A₁	155	150	6.62
3	E	353	342	67.89
3	E	353	342	67.90
4	E	118	114	1.72
4	E	118	114	1.72

Atom	x (Å)	y (Å)	z (Å)
As1	0.000	0.000	0.648
Cl2	0.000	2.039	-0.419
Cl3	1.766	-1.020	-0.419
Cl4	-1.766	-1.020	-0.419

	As1	Cl2	Cl3	Cl4
As1		2.3020	2.3020	2.3020
Cl2	2.3020		3.5325	3.5325
Cl3	2.3020	3.5325		3.5325
Cl4	2.3020	3.5325	3.5325

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Cl2	As1	Cl3	100.219		Cl2	As1	Cl4	100.219
Cl3	As1	Cl4	100.219

All results from a given calculation for AsCl₃ (Arsenous trichloride)

using model chemistry: TPSSh/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	0.746
2	Cl	-0.249
3	Cl	-0.249
4	Cl	-0.249

	x	y	z	Total
	0.000	0.000	2.820	2.820
CHELPG
AIM
ESP

	x	y	z
x	10.228	0.000	0.000
y	0.000	10.228	0.001
z	0.000	0.001	5.260

<r²>	272.037
(<r²>)^1/2	16.494

All results from a given calculation for AsCl3 (Arsenous trichloride)

using model chemistry: TPSSh/3-21G

States and conformations

All results from a given calculation for AsCl₃ (Arsenous trichloride)