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	hartrees
Energy at 0K	-695.910798
Energy at 298.15K	-695.912250
HF Energy	-695.910798
Nuclear repulsion energy	196.340951

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	975	886	133.58
2	A'	639	581	17.43
3	A'	429	390	19.85
4	A'	197	179	7.15
5	A"	742	674	686.70
6	A"	544	494	1.94

Atom	x (Å)	y (Å)	z (Å)
S1	-0.310	-0.203	0.000
F2	1.173	0.169	0.000
F3	-0.310	0.096	1.597
F4	-0.310	0.096	-1.597

	S1	F2	F3	F4
S1		1.5291	1.6251	1.6251
F2	1.5291		2.1809	2.1809
F3	1.6251	2.1809		3.1945
F4	1.6251	2.1809	3.1945

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	S1	F3	87.428		F2	S1	F4	87.428
F3	S1	F4	158.766

All results from a given calculation for SF₃ (Sulfur trifluoride)

using model chemistry: HF/aug-cc-pVQZ

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	S	1.717
2	F	-0.539
3	F	-0.589
4	F	-0.589

	x	y	z	Total
	-0.527	-0.556	0.000	0.766
CHELPG
AIM
ESP

	x	y	z
x	3.278	0.038	0.000
y	0.038	2.891	0.000
z	0.000	0.000	4.377

<r²>	80.352
(<r²>)^1/2	8.964

All results from a given calculation for SF3 (Sulfur trifluoride)

using model chemistry: HF/aug-cc-pVQZ

States and conformations

All results from a given calculation for SF₃ (Sulfur trifluoride)