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	hartrees
Energy at 0K	-872.243470
Energy at 298.15K	-872.246002
HF Energy	-872.243470
Nuclear repulsion energy	374.778502

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1025	970	113.66
2	A₁	652	617	23.18
3	A₁	564	534	0.16
4	A₁	390	369	31.64
5	A₁	104	98	0.01
6	A₂	383	363	0.00
7	B₁	804	761	146.99
8	B₁	388	367	26.00
9	B₁	217	205	0.44
10	B₂	832	787	248.07
11	B₂	429	407	28.67
12	B₂	354	335	1.94

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.159
O2	0.000	0.000	1.736
F3	0.000	1.719	-0.151
F4	0.000	-1.719	-0.151
F5	1.466	0.000	-0.761
F6	-1.466	0.000	-0.761

	S1	O2	F3	F4	F5	F6
S1		1.5774	1.7468	1.7468	1.7305	1.7305
O2	1.5774		2.5530	2.5530	2.8957	2.8957
F3	1.7468	2.5530		3.4381	2.3400	2.3400
F4	1.7468	2.5530	3.4381		2.3400	2.3400
F5	1.7305	2.8957	2.3400	2.3400		2.9316
F6	1.7305	2.8957	2.3400	2.3400	2.9316

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	100.226	O2	S1	F4	100.226
O2	S1	F5	122.110	O2	S1	F6	122.110
F3	S1	F4	159.548	F3	S1	F5	84.585
F3	S1	F6	84.585	F4	S1	F5	84.585
F4	S1	F6	84.585	F5	S1	F6	115.780

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

using model chemistry: mPW1PW91/6-31G

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	1.658
2	O	-0.449
3	F	-0.328
4	F	-0.328
5	F	-0.276
6	F	-0.276

	x	y	z	Total
	0.000	0.000	-0.335	0.335
CHELPG
AIM
ESP

<r²>	152.596
(<r²>)^1/2	12.353

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

using model chemistry: mPW1PW91/6-31G

States and conformations

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