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	hartrees
Energy at 0K	-796.941765
Energy at 298.15K
HF Energy	-796.941765
Nuclear repulsion energy	295.488235

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	900	857	104.68	10.12	0.00	0.00
2	A₁	607	579	2.74	8.40	0.49	0.65
3	A₁	507	483	22.40	1.32	0.32	0.49
4	A₁	196	187	0.45	0.37	0.73	0.85
5	A₂	451	430	0.00	1.18	0.75	0.86
6	B₁	887	845	155.52	3.90	0.75	0.86
7	B₁	345	329	10.07	0.09	0.75	0.86
8	B₂	836	797	529.49	1.15	0.75	0.86
9	B₂	514	490	3.36	0.68	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.390
F2	0.000	1.652	0.260
F3	0.000	-1.652	0.260
F4	1.229	0.000	-0.606
F5	-1.229	0.000	-0.606

	S1	F2	F3	F4	F5
S1		1.6574	1.6574	1.5814	1.5814
F2	1.6574		3.3047	2.2338	2.2338
F3	1.6574	3.3047		2.2338	2.2338
F4	1.5814	2.2338	2.2338		2.4575
F5	1.5814	2.2338	2.2338	2.4575

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	171.020	F2	S1	F4	87.175
F2	S1	F5	87.175	F3	S1	F4	87.175
F3	S1	F5	87.175	F4	S1	F5	101.972

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

using model chemistry: PBE1PBE/6-31G**

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	1.334
2	F	-0.386
3	F	-0.386
4	F	-0.281
5	F	-0.281

	x	y	z	Total
	0.000	0.000	0.827	0.827
CHELPG
AIM
ESP

<r²>	106.730
(<r²>)^1/2	10.331

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

using model chemistry: PBE1PBE/6-31G**

States and conformations

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