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	hartrees
Energy at 0K	-868.266673
Energy at 298.15K	-868.270135
HF Energy	-868.266673
Nuclear repulsion energy	406.565001

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1365	1318	203.47
2	A₁	781	755	34.56
3	A₁	654	631	1.76
4	A₁	523	505	34.99
5	A₁	134	129	0.01
6	A₂	518	500	0.00
7	B₁	959	926	220.74
8	B₁	521	503	29.12
9	B₁	269	259	0.33
10	B₂	955	922	368.00
11	B₂	585	565	41.28
12	B₂	498	481	0.12

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.142
O2	0.000	0.000	1.584
F3	0.000	1.593	-0.126
F4	0.000	-1.593	-0.126
F5	1.352	0.000	-0.704
F6	-1.352	0.000	-0.704

	S1	O2	F3	F4	F5	F6
S1		1.4423	1.6155	1.6155	1.5943	1.5943
O2	1.4423		2.3369	2.3369	2.6574	2.6574
F3	1.6155	2.3369		3.1866	2.1679	2.1679
F4	1.6155	2.3369	3.1866		2.1679	2.1679
F5	1.5943	2.6574	2.1679	2.1679		2.7032
F6	1.5943	2.6574	2.1679	2.1679	2.7032

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	99.520	O2	S1	F4	99.520
O2	S1	F5	122.031	O2	S1	F6	122.031
F3	S1	F4	160.960	F3	S1	F5	84.968
F3	S1	F6	84.968	F4	S1	F5	84.968
F4	S1	F6	84.968	F5	S1	F6	115.937

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

using model chemistry: TPSSh/3-21G*

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	1.460
2	O	-0.395
3	F	-0.295
4	F	-0.295
5	F	-0.237
6	F	-0.237

	x	y	z	Total
	0.000	0.000	-1.004	1.004
CHELPG
AIM
ESP

<r²>	131.667
(<r²>)^1/2	11.475

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

using model chemistry: TPSSh/3-21G*

States and conformations

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