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	hartrees
Energy at 0K	-797.023495
Energy at 298.15K
HF Energy	-797.023495
Nuclear repulsion energy	291.300297

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	875	841	111.95	11.16	0.00	0.00
2	A₁	594	571	3.28	10.03	0.48	0.65
3	A₁	488	470	24.17	1.66	0.34	0.50
4	A₁	207	199	0.57	0.49	0.72	0.84
5	A₂	424	407	0.00	1.65	0.75	0.86
6	B₁	859	826	162.93	4.84	0.75	0.86
7	B₁	325	313	11.68	0.15	0.75	0.86
8	B₂	822	790	562.77	1.17	0.75	0.86
9	B₂	489	470	3.13	1.06	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.391
F2	0.000	1.678	0.280
F3	0.000	-1.678	0.280
F4	1.236	0.000	-0.628
F5	-1.236	0.000	-0.628

	S1	F2	F3	F4	F5
S1		1.6821	1.6821	1.6015	1.6015
F2	1.6821		3.3568	2.2733	2.2733
F3	1.6821	3.3568		2.2733	2.2733
F4	1.6015	2.2733	2.2733		2.4715
F5	1.6015	2.2733	2.2733	2.4715

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	172.439	F2	S1	F4	87.596
F2	S1	F5	87.596	F3	S1	F4	87.596
F3	S1	F5	87.596	F4	S1	F5	101.001

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

using model chemistry: HSEh1PBE/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	1.174
2	F	-0.350
3	F	-0.350
4	F	-0.237
5	F	-0.237

	x	y	z	Total
	0.000	0.000	1.045	1.045
CHELPG
AIM
ESP

<r²>	109.676
(<r²>)^1/2	10.473

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

using model chemistry: HSEh1PBE/cc-pVDZ

States and conformations

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