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	hartrees
Energy at 0K	-797.713987
Energy at 298.15K
HF Energy	-797.713987
Nuclear repulsion energy	295.888400

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	870	870	114.86
2	A₁	547	547	4.04
3	A₁	510	510	18.95
4	A₁	219	219	0.77
5	A₂	448	448	0.00
6	B₁	836	836	174.09
7	B₁	339	339	9.66
8	B₂	734	734	601.61
9	B₂	515	515	0.04

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.379
F2	0.000	1.662	0.279
F3	0.000	-1.662	0.279
F4	1.210	0.000	-0.616
F5	-1.210	0.000	-0.616

	S1	F2	F3	F4	F5
S1		1.6650	1.6650	1.5666	1.5666
F2	1.6650		3.3240	2.2422	2.2422
F3	1.6650	3.3240		2.2422	2.2422
F4	1.5666	2.2422	2.2422		2.4201
F5	1.5666	2.2422	2.2422	2.4201

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	173.122	F2	S1	F4	87.817
F2	S1	F5	87.817	F3	S1	F4	87.817
F3	S1	F5	87.817	F4	S1	F5	101.144

All results from a given calculation for SF₄ (Sulfur tetrafluoride)

using model chemistry: B3LYPultrafine/cc-pCVTZ

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	0.914
2	F	-0.299
3	F	-0.299
4	F	-0.158
5	F	-0.158

	x	y	z	Total
	0.000	0.000	0.691	0.691
CHELPG
AIM
ESP

<r²>	107.215
(<r²>)^1/2	10.354

All results from a given calculation for SF4 (Sulfur tetrafluoride)

using model chemistry: B3LYPultrafine/cc-pCVTZ

States and conformations

All results from a given calculation for SF₄ (Sulfur tetrafluoride)