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	hartrees
Energy at 0K	-122.738209
Energy at 298.15K	-122.741621
HF Energy	-122.738209
Nuclear repulsion energy	169.515452

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1352	1352	250.89
2	A₁	765	765	59.76
3	A₁	581	581	2.80
4	A₁	531	531	29.47
5	A₁	163	163	0.02
6	A₂	517	517	0.00
7	B₁	895	895	271.35
8	B₁	523	523	23.68
9	B₁	246	246	0.25
10	B₂	828	828	497.40
11	B₂	595	595	32.03
12	B₂	516	516	0.05

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.142
O2	0.000	0.000	1.583
F3	0.000	1.617	-0.082
F4	0.000	-1.617	-0.082
F5	1.314	0.000	-0.748
F6	-1.314	0.000	-0.748

	S1	O2	F3	F4	F5	F6
S1		1.4406	1.6325	1.6325	1.5873	1.5873
O2	1.4406		2.3207	2.3207	2.6758	2.6758
F3	1.6325	2.3207		3.2342	2.1877	2.1877
F4	1.6325	2.3207	3.2342		2.1877	2.1877
F5	1.5873	2.6758	2.1877	2.1877		2.6282
F6	1.5873	2.6758	2.1877	2.1877	2.6282

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	97.883	O2	S1	F4	97.883
O2	S1	F5	124.116	O2	S1	F6	124.116
F3	S1	F4	164.233	F3	S1	F5	85.588
F3	S1	F6	85.588	F4	S1	F5	85.588
F4	S1	F6	85.588	F5	S1	F6	111.767

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

using model chemistry: wB97X-D/CEP-121G*

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	1.180
2	O	-0.287
3	F	-0.269
4	F	-0.269
5	F	-0.177
6	F	-0.177

	x	y	z	Total
	0.000	0.000	-1.016	1.016
CHELPG
AIM
ESP

<r²>	107.528
(<r²>)^1/2	10.370

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

using model chemistry: wB97X-D/CEP-121G*

States and conformations

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