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	hartrees
Energy at 0K	-885.412209
Energy at 298.15K	-885.414192
HF Energy	-885.412209
Nuclear repulsion energy	389.318520

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	824	824	17.90
2	A₁	617	617	11.03
3	A₁	398	398	23.44
4	B₁	317	317	0.00
5	B₂	600	600	0.00
6	B₂	169	169	0.00
7	E	863	863	140.06
7	E	863	863	140.06
8	E	387	387	9.38
8	E	387	387	9.38
9	E	217	217	0.46
9	E	217	217	0.46

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	0.310
F2	0.000	0.000	-1.395
F3	0.000	1.723	0.211
F4	-1.723	0.000	0.211
F5	0.000	-1.723	0.211
F6	1.723	0.000	0.211

	S1	F2	F3	F4	F5	F6
S1		1.7045	1.7261	1.7261	1.7261	1.7261
F2	1.7045		2.3553	2.3553	2.3553	2.3553
F3	1.7261	2.3553		2.4370	3.4465	2.4370
F4	1.7261	2.3553	2.4370		2.4370	3.4465
F5	1.7261	2.3553	3.4465	2.4370		2.4370
F6	1.7261	2.3553	2.4370	3.4465	2.4370

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	S1	F3	86.717	F2	S1	F4	86.717
F2	S1	F5	86.717	F2	S1	F6	86.717
F3	S1	F4	89.812	F3	S1	F5	173.434
F3	S1	F6	89.812	F4	S1	F5	89.812
F4	S1	F6	173.434	F5	S1	F6	89.812

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

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

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	0.938
2	F	-0.165
3	F	-0.193
4	F	-0.193
5	F	-0.193
6	F	-0.193

	x	y	z	Total
	0.000	0.000	0.904	0.904
CHELPG
AIM
ESP

<r²>	148.352
(<r²>)^1/2	12.180

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

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

States and conformations

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