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	hartrees
Energy at 0K	-797.608548
Energy at 298.15K
HF Energy	-797.608548
Nuclear repulsion energy	296.590697

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	889	852	103.29	11.81	0.00	0.01
2	A₁	559	536	3.35	10.83	0.43	0.60
3	A₁	515	493	19.89	2.22	0.12	0.22
4	A₁	217	208	0.92	0.36	0.63	0.77
5	A₂	454	435	0.00	0.90	0.75	0.86
6	B₁	862	825	170.90	3.94	0.75	0.86
7	B₁	343	328	10.07	0.06	0.75	0.86
8	B₂	734	704	636.31	0.89	0.75	0.86
9	B₂	521	499	0.02	0.44	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.381
F2	0.000	1.659	0.268
F3	0.000	-1.659	0.268
F4	1.211	0.000	-0.607
F5	-1.211	0.000	-0.607

	S1	F2	F3	F4	F5
S1		1.6633	1.6633	1.5625	1.5625
F2	1.6633		3.3188	2.2323	2.2323
F3	1.6633	3.3188		2.2323	2.2323
F4	1.5625	2.2323	2.2323		2.4211
F5	1.5625	2.2323	2.2323	2.4211

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	172.166	F2	S1	F4	87.525
F2	S1	F5	87.525	F3	S1	F4	87.525
F3	S1	F5	87.525	F4	S1	F5	101.568

All results from a given calculation for SF₄ (Sulfur tetrafluoride)

using model chemistry: mPW1PW91/aug-cc-pVTZ

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	1.669
2	F	-0.467
3	F	-0.467
4	F	-0.368
5	F	-0.368

	x	y	z	Total
	0.000	0.000	0.695	0.695
CHELPG
AIM
ESP

<r²>	106.961
(<r²>)^1/2	10.342

All results from a given calculation for SF4 (Sulfur tetrafluoride)

using model chemistry: mPW1PW91/aug-cc-pVTZ

States and conformations

All results from a given calculation for SF₄ (Sulfur tetrafluoride)