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	hartrees
Energy at 0K	-872.273564
Energy at 298.15K	-872.276859
HF Energy	-871.873164
Nuclear repulsion energy	400.696259

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1282	1282	196.41
2	A₁	726	726	55.37
3	A₁	575	575	1.19
4	A₁	506	506	24.89
5	A₁	169	169	0.02
6	A₂	486	486	0.00
7	B₁	863	863	229.08
8	B₁	496	496	17.88
9	B₁	230	230	0.13
10	B₂	820	820	450.55
11	B₂	565	565	27.49
12	B₂	490	490	0.02

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.148
O2	0.000	0.000	1.603
F3	0.000	1.638	-0.073
F4	0.000	-1.638	-0.073
F5	1.320	0.000	-0.771
F6	-1.320	0.000	-0.771

	S1	O2	F3	F4	F5	F6
S1		1.4555	1.6531	1.6531	1.6085	1.6085
O2	1.4555		2.3442	2.3442	2.7166	2.7166
F3	1.6531	2.3442		3.2765	2.2166	2.2166
F4	1.6531	2.3442	3.2765		2.2166	2.2166
F5	1.6085	2.7166	2.2166	2.2166		2.6406
F6	1.6085	2.7166	2.2166	2.2166	2.6406

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	S1	F3	97.691	O2	S1	F4	97.691
O2	S1	F5	124.832	O2	S1	F6	124.832
F3	S1	F4	164.619	F3	S1	F5	85.616
F3	S1	F6	85.616	F4	S1	F5	85.616
F4	S1	F6	85.616	F5	S1	F6	110.335

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

using model chemistry: B2PLYP/aug-cc-pVDZ

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	2.380
2	O	-0.558
3	F	-0.483
4	F	-0.483
5	F	-0.428
6	F	-0.428

	x	y	z	Total
	0.000	0.000	-0.820	0.820
CHELPG
AIM
ESP

<r²>	135.924
(<r²>)^1/2	11.659

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

using model chemistry: B2PLYP/aug-cc-pVDZ

States and conformations

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