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	hartrees
Energy at 0K	-797.190831
Energy at 298.15K
HF Energy	-797.190831
Nuclear repulsion energy	292.069521

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	822	812	104.19	12.41	0.00	0.00
2	A₁	518	512	4.72	10.27	0.50	0.67
3	A₁	473	467	13.80	2.62	0.21	0.34
4	A₁	205	203	0.79	0.56	0.69	0.81
5	A₂	417	412	0.00	1.48	0.75	0.86
6	B₁	788	778	173.96	4.77	0.75	0.86
7	B₁	311	308	7.80	0.11	0.75	0.86
8	B₂	706	697	577.02	1.16	0.75	0.86
9	B₂	480	474	0.43	0.84	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.381
F2	0.000	1.683	0.293
F3	0.000	-1.683	0.293
F4	1.223	0.000	-0.631
F5	-1.223	0.000	-0.631

	S1	F2	F3	F4	F5
S1		1.6849	1.6849	1.5871	1.5871
F2	1.6849		3.3653	2.2761	2.2761
F3	1.6849	3.3653		2.2761	2.2761
F4	1.5871	2.2761	2.2761		2.4453
F5	1.5871	2.2761	2.2761	2.4453

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	174.050	F2	S1	F4	88.104
F2	S1	F5	88.104	F3	S1	F4	88.104
F3	S1	F5	88.104	F4	S1	F5	100.774

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

using model chemistry: PBEPBE/Def2TZVPP

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	0.720
2	F	-0.245
3	F	-0.245
4	F	-0.115
5	F	-0.115

	x	y	z	Total
	0.000	0.000	0.635	0.635
CHELPG
AIM
ESP

<r²>	109.629
(<r²>)^1/2	10.470

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

using model chemistry: PBEPBE/Def2TZVPP

States and conformations

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