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	hartrees
Energy at 0K	-797.725580
Energy at 298.15K
HF Energy	-797.725580
Nuclear repulsion energy	295.729965

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	868	836	116.40	11.03	0.00	0.00
2	A₁	537	517	3.35	9.65	0.50	0.67
3	A₁	508	489	19.64	2.26	0.23	0.37
4	A₁	219	211	0.91	0.43	0.70	0.82
5	A₂	446	429	0.00	1.23	0.75	0.86
6	B₁	834	802	183.12	4.54	0.75	0.86
7	B₁	336	323	10.04	0.09	0.75	0.86
8	B₂	714	687	636.56	1.27	0.75	0.86
9	B₂	512	493	0.55	0.65	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.379
F2	0.000	1.665	0.279
F3	0.000	-1.665	0.279
F4	1.210	0.000	-0.615
F5	-1.210	0.000	-0.615

	S1	F2	F3	F4	F5
S1		1.6677	1.6677	1.5658	1.5658
F2	1.6677		3.3293	2.2436	2.2436
F3	1.6677	3.3293		2.2436	2.2436
F4	1.5658	2.2436	2.2436		2.4191
F5	1.5658	2.2436	2.2436	2.4191

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	173.107	F2	S1	F4	87.812
F2	S1	F5	87.812	F3	S1	F4	87.812
F3	S1	F5	87.812	F4	S1	F5	101.153

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

using model chemistry: B3LYP/Def2TZVPP

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	0.886
2	F	-0.291
3	F	-0.291
4	F	-0.153
5	F	-0.153

	x	y	z	Total
	0.000	0.000	0.715	0.715
CHELPG
AIM
ESP

<r²>	107.519
(<r²>)^1/2	10.369

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

using model chemistry: B3LYP/Def2TZVPP

States and conformations

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