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	hartrees
Energy at 0K	-796.971406
Energy at 298.15K
HF Energy	-796.971406
Nuclear repulsion energy	292.864587

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	824	816	82.99	10.90	0.00	0.00
2	A₁	543	537	3.01	8.42	0.44	0.62
3	A₁	475	470	10.89	1.83	0.17	0.30
4	A₁	198	196	0.48	0.37	0.71	0.83
5	A₂	419	415	0.00	1.11	0.75	0.86
6	B₁	802	793	128.13	3.42	0.75	0.86
7	B₁	314	310	5.77	0.08	0.75	0.86
8	B₂	755	747	444.09	0.91	0.75	0.86
9	B₂	482	477	0.16	0.62	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.384
F2	0.000	1.671	0.284
F3	0.000	-1.671	0.284
F4	1.228	0.000	-0.626
F5	-1.228	0.000	-0.626

	S1	F2	F3	F4	F5
S1		1.6741	1.6741	1.5900	1.5900
F2	1.6741		3.3423	2.2648	2.2648
F3	1.6741	3.3423		2.2648	2.2648
F4	1.5900	2.2648	2.2648		2.4560
F5	1.5900	2.2648	2.2648	2.4560

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	173.169	F2	S1	F4	87.831
F2	S1	F5	87.831	F3	S1	F4	87.831
F3	S1	F5	87.831	F4	S1	F5	101.124

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

using model chemistry: PBEPBEultrafine/6-31G(2df,p)

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	0.463
2	F	-0.206
3	F	-0.206
4	F	-0.025
5	F	-0.025

	x	y	z	Total
	0.000	0.000	0.489	0.489
CHELPG
AIM
ESP

<r²>	108.197
(<r²>)^1/2	10.402

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

using model chemistry: PBEPBEultrafine/6-31G(2df,p)

States and conformations

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