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	hartrees
Energy at 0K	-897.079562
Energy at 298.15K	-897.082874
HF Energy	-897.079562
Nuclear repulsion energy	409.501411

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	928	928	156.95
2	A₁	670	670	8.33
3	A₁	527	527	39.75
4	B₁	432	432	0.00
5	B₂	637	637	0.00
6	B₂	229	229	0.00
7	E	894	894	468.05
7	E	894	894	468.05
8	E	498	498	6.33
8	E	498	498	6.33
9	E	340	340	0.13
9	E	340	340	0.13

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.209
F2	0.000	0.000	-1.370
F3	0.000	1.635	0.249
F4	-1.635	0.000	0.249
F5	0.000	-1.635	0.249
F6	1.635	0.000	0.249

	S1	F2	F3	F4	F5	F6
S1		1.5789	1.6355	1.6355	1.6355	1.6355
F2	1.5789		2.3010	2.3010	2.3010	2.3010
F3	1.6355	2.3010		2.3123	3.2701	2.3123
F4	1.6355	2.3010	2.3123		2.3123	3.2701
F5	1.6355	2.3010	3.2701	2.3123		2.3123
F6	1.6355	2.3010	2.3123	3.2701	2.3123

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	91.408	F2	S1	F4	91.408
F2	S1	F5	91.408	F2	S1	F6	91.408
F3	S1	F4	89.965	F3	S1	F5	177.184
F3	S1	F6	89.965	F4	S1	F5	89.965
F4	S1	F6	177.184	F5	S1	F6	89.965

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

using model chemistry: M06-2X/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	1.374
2	F	-0.238
3	F	-0.284
4	F	-0.284
5	F	-0.284
6	F	-0.284

	x	y	z	Total
	0.000	0.000	0.616	0.616
CHELPG
AIM
ESP

<r²>	139.840
(<r²>)^1/2	11.825

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

using model chemistry: M06-2X/cc-pVDZ

States and conformations

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