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	hartrees
Energy at 0K	-860.710498
Energy at 298.15K	-860.712325
HF Energy	-860.710498
Nuclear repulsion energy	372.904254

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1044	922	59.37
2	A₁	657	580	10.03
3	A₁	600	530	0.55
4	A₁	355	314	15.84
5	A₁	72	63	0.47
6	A₂	341	301	0.00
7	B₁	789	697	79.53
8	B₁	334	295	14.42
9	B₁	125	110	2.31
10	B₂	912	806	150.37
11	B₂	392	346	22.03
12	B₂	344	304	0.45

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.163
O2	0.000	0.000	1.762
F3	0.000	1.722	-0.097
F4	0.000	-1.722	-0.097
F5	1.437	0.000	-0.831
F6	-1.437	0.000	-0.831

	S1	O2	F3	F4	F5	F6
S1		1.5991	1.7414	1.7414	1.7471	1.7471
O2	1.5991		2.5337	2.5337	2.9647	2.9647
F3	1.7414	2.5337		3.4439	2.3598	2.3598
F4	1.7414	2.5337	3.4439		2.3598	2.3598
F5	1.7471	2.9647	2.3598	2.3598		2.8734
F6	1.7471	2.9647	2.3598	2.3598	2.8734

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	98.572	O2	S1	F4	98.572
O2	S1	F5	124.684	O2	S1	F6	124.684
F3	S1	F4	162.856	F3	S1	F5	85.135
F3	S1	F6	85.135	F4	S1	F5	85.135
F4	S1	F6	85.135	F5	S1	F6	110.633

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

using model chemistry: HSEh1PBE/STO-3G

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	0.954
2	O	-0.318
3	F	-0.175
4	F	-0.175
5	F	-0.143
6	F	-0.143

	x	y	z	Total
	0.000	0.000	-0.837	0.837
CHELPG
AIM
ESP

<r²>	149.659
(<r²>)^1/2	12.234

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

using model chemistry: HSEh1PBE/STO-3G

States and conformations

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