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	hartrees
Energy at 0K	-872.907333
Energy at 298.15K	-872.910803
HF Energy	-872.907333
Nuclear repulsion energy	408.707206

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1351	1306	220.31
2	A₁	758	732	57.03
3	A₁	573	554	4.00
4	A₁	539	521	24.13
5	A₁	163	158	0.00
6	A₂	531	513	0.00
7	B₁	883	853	255.89
8	B₁	533	515	18.37
9	B₁	253	244	0.08
10	B₂	811	784	473.77
11	B₂	608	587	25.11
12	B₂	526	509	0.01

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.139
O2	0.000	0.000	1.565
F3	0.000	1.608	-0.085
F4	0.000	-1.608	-0.085
F5	1.309	0.000	-0.734
F6	-1.309	0.000	-0.734

	S1	O2	F3	F4	F5	F6
S1		1.4255	1.6239	1.6239	1.5735	1.5735
O2	1.4255		2.3042	2.3042	2.6452	2.6452
F3	1.6239	2.3042		3.2165	2.1728	2.1728
F4	1.6239	2.3042	3.2165		2.1728	2.1728
F5	1.5735	2.6452	2.1728	2.1728		2.6182
F6	1.5735	2.6452	2.1728	2.1728	2.6182

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	97.948	O2	S1	F4	97.948
O2	S1	F5	123.699	O2	S1	F6	123.699
F3	S1	F4	164.105	F3	S1	F5	85.600
F3	S1	F6	85.600	F4	S1	F5	85.600
F4	S1	F6	85.600	F5	S1	F6	112.601

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

using model chemistry: B3LYPultrafine/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	1.144
2	O	-0.341
3	F	-0.247
4	F	-0.247
5	F	-0.154
6	F	-0.154

	x	y	z	Total
	0.000	0.000	-1.079	1.079
CHELPG
AIM
ESP

<r²>	131.085
(<r²>)^1/2	11.449

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

using model chemistry: B3LYPultrafine/cc-pVTZ

States and conformations

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