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	hartrees
Energy at 0K	-1357.287458
Energy at 298.15K	-1357.291546
HF Energy	-1357.287458
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	888	842	413.99
2	A₁	714	677	3.19
3	A₁	583	553	101.40
4	A₁	401	380	2.79
5	B₁	472	448	0.00
6	B₂	658	624	0.00
7	B₂	319	303	0.00
8	E	969	919	343.30
8	E	969	919	343.30
9	E	544	516	18.25
9	E	544	516	18.25
10	E	415	393	1.76
10	E	415	393	1.76
11	E	251	238	0.10
11	E	251	238	0.10

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.260
Cl2	0.000	0.000	1.800
F3	0.000	1.589	-0.273
F4	1.589	0.000	-0.273
F5	0.000	-1.589	-0.273
F6	-1.589	0.000	-0.273
F7	0.000	0.000	-1.845

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.0595	1.5887	1.5887	1.5887	1.5887	1.5850
Cl2	2.0595		2.6119	2.6119	2.6119	2.6119	3.6445
F3	1.5887	2.6119		2.2467	3.1773	2.2467	2.2344
F4	1.5887	2.6119	2.2467		2.2467	3.1773	2.2344
F5	1.5887	2.6119	3.1773	2.2467		2.2467	2.2344
F6	1.5887	2.6119	2.2467	3.1773	2.2467		2.2344
F7	1.5850	3.6445	2.2344	2.2344	2.2344	2.2344

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	90.493	Cl2	S1	F4	90.493
Cl2	S1	F5	90.493	Cl2	S1	F6	90.493
Cl2	S1	F7	180.000	F3	S1	F4	89.996
F3	S1	F5	179.013	F3	S1	F6	89.996
F3	S1	F7	89.507	F4	S1	F5	89.996
F4	S1	F6	179.013	F4	S1	F7	89.507
F5	S1	F6	89.996	F5	S1	F7	89.507
F6	S1	F7	89.507

All results from a given calculation for SF₅Cl (sulfur chloropentafluoride)

using model chemistry: wB97X-D/6-31G*

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	1.510
2	Cl	-0.063
3	F	-0.291
4	F	-0.291
5	F	-0.291
6	F	-0.291
7	F	-0.283

	x	y	z	Total
	0.000	0.000	0.331	0.331
CHELPG
AIM
ESP

<r²>	213.324
(<r²>)^1/2	14.606

All results from a given calculation for SF5Cl (sulfur chloropentafluoride)

using model chemistry: wB97X-D/6-31G*

States and conformations

All results from a given calculation for SF₅Cl (sulfur chloropentafluoride)