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	hartrees
Energy at 0K	-892.239646
Energy at 298.15K	-892.242248
HF Energy	-892.239646
Nuclear repulsion energy	397.079002

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	928	889	87.80
2	A₁	634	608	1.46
3	A₁	427	409	54.54
4	B₁	336	323	0.00
5	B₂	630	604	0.00
6	B₂	164	157	0.00
7	E	869	833	265.42
7	E	869	833	265.42
8	E	401	385	11.26
8	E	401	385	11.26
9	E	249	239	1.33
9	E	249	239	1.33

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.235
F2	0.000	0.000	-1.392
F3	0.000	1.691	0.244
F4	-1.691	0.000	0.244
F5	0.000	-1.691	0.244
F6	1.691	0.000	0.244

	S1	F2	F3	F4	F5	F6
S1		1.6273	1.6905	1.6905	1.6905	1.6905
F2	1.6273		2.3525	2.3525	2.3525	2.3525
F3	1.6905	2.3525		2.3908	3.3810	2.3908
F4	1.6905	2.3525	2.3908		2.3908	3.3810
F5	1.6905	2.3525	3.3810	2.3908		2.3908
F6	1.6905	2.3525	2.3908	3.3810	2.3908

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	90.293	F2	S1	F4	90.293
F2	S1	F5	90.293	F2	S1	F6	90.293
F3	S1	F4	89.999	F3	S1	F5	179.414
F3	S1	F6	89.999	F4	S1	F5	89.999
F4	S1	F6	179.414	F5	S1	F6	89.999

All results from a given calculation for SF₅ (Sulfur pentafluoride)

using model chemistry: M06-2X/3-21G

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	1.760
2	F	-0.339
3	F	-0.355
4	F	-0.355
5	F	-0.355
6	F	-0.355

	x	y	z	Total
	0.000	0.000	1.110	1.110
CHELPG
AIM
ESP

<r²>	147.615
(<r²>)^1/2	12.150

All results from a given calculation for SF5 (Sulfur pentafluoride)

using model chemistry: M06-2X/3-21G

States and conformations

All results from a given calculation for SF₅ (Sulfur pentafluoride)