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	hartrees
Energy at 0K	-122.494310
Energy at 298.15K	-122.496430
HF Energy	-122.494310
Nuclear repulsion energy	152.317082

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	919	896	104.36
2	A₁	577	562	29.20
3	A₁	496	483	0.22
4	A₁	350	341	26.03
5	A₁	83	81	0.09
6	A₂	350	341	0.00
7	B₁	698	680	144.63
8	B₁	346	338	17.47
9	B₁	189	184	0.34
10	B₂	732	714	249.72
11	B₂	390	380	19.40
12	B₂	328	320	0.63

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.168
O2	0.000	0.000	1.765
F3	0.000	1.773	-0.150
F4	0.000	-1.773	-0.150
F5	1.513	0.000	-0.784
F6	-1.513	0.000	-0.784

	S1	O2	F3	F4	F5	F6
S1		1.5975	1.8015	1.8015	1.7871	1.7871
O2	1.5975		2.6098	2.6098	2.9640	2.9640
F3	1.8015	2.6098		3.5467	2.4157	2.4157
F4	1.8015	2.6098	3.5467		2.4157	2.4157
F5	1.7871	2.9640	2.4157	2.4157		3.0257
F6	1.7871	2.9640	2.4157	2.4157	3.0257

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	100.145	O2	S1	F4	100.145
O2	S1	F5	122.165	O2	S1	F6	122.165
F3	S1	F4	159.711	F3	S1	F5	84.620
F3	S1	F6	84.620	F4	S1	F5	84.620
F4	S1	F6	84.620	F5	S1	F6	115.669

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

using model chemistry: B3LYP/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	1.284
2	O	-0.265
3	F	-0.280
4	F	-0.280
5	F	-0.229
6	F	-0.229

	x	y	z	Total
	0.000	0.000	0.152	0.152
CHELPG
AIM
ESP

<r²>	129.494
(<r²>)^1/2	11.380

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

using model chemistry: B3LYP/CEP-121G

States and conformations

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