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	hartrees
Energy at 0K	-872.548105
Energy at 298.15K	-872.551603
HF Energy	-872.064155
Nuclear repulsion energy	409.771800

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1349	1296	214.75
2	A₁	764	734	55.80
3	A₁	575	552	3.68
4	A₁	543	522	24.62
5	A₁	168	162	0.00
6	A₂	536	515	0.00
7	B₁	892	857	245.02
8	B₁	536	515	18.83
9	B₁	255	245	0.07
10	B₂	803	771	469.17
11	B₂	611	587	29.62
12	B₂	529	508	0.00

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.138
O2	0.000	0.000	1.564
F3	0.000	1.605	-0.084
F4	0.000	-1.605	-0.084
F5	1.302	0.000	-0.734
F6	-1.302	0.000	-0.734

	S1	O2	F3	F4	F5	F6
S1		1.4260	1.6204	1.6204	1.5667	1.5667
O2	1.4260		2.3008	2.3008	2.6409	2.6409
F3	1.6204	2.3008		3.2101	2.1661	2.1661
F4	1.6204	2.3008	3.2101		2.1661	2.1661
F5	1.5667	2.6409	2.1661	2.1661		2.6034
F6	1.5667	2.6409	2.1661	2.1661	2.6034

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	97.892	O2	S1	F4	97.892
O2	S1	F5	123.811	O2	S1	F6	123.811
F3	S1	F4	164.215	F3	S1	F5	85.618
F3	S1	F6	85.618	F4	S1	F5	85.618
F4	S1	F6	85.618	F5	S1	F6	112.378

All results from a given calculation for SOF₄ (Sulfur tetrafluoride oxide)

using model chemistry: B2PLYP/aug-cc-pVTZ

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	2.096
2	O	-0.560
3	F	-0.441
4	F	-0.441
5	F	-0.327
6	F	-0.327

	x	y	z	Total
	0.000	0.000	-1.081	1.081
CHELPG
AIM
ESP

<r²>	130.801
(<r²>)^1/2	11.437

All results from a given calculation for SOF4 (Sulfur tetrafluoride oxide)

using model chemistry: B2PLYP/aug-cc-pVTZ

States and conformations

All results from a given calculation for SOF₄ (Sulfur tetrafluoride oxide)