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	hartrees
Energy at 0K	-1346.088266
Energy at 298.15K	-1346.090948
HF Energy	-1346.088266
Nuclear repulsion energy	594.784111

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	862	846	234.58
2	A₁	632	620	2.50
3	A₁	441	433	108.82
4	A₁	291	286	0.60
5	B₁	330	324	0.00
6	B₂	627	615	0.00
7	B₂	206	202	0.00
8	E	932	915	186.12
8	E	932	915	186.12
9	E	389	382	21.32
9	E	389	382	21.32
10	E	278	273	3.39
10	E	278	273	3.39
11	E	151	148	0.79
11	E	151	148	0.79

Atom	x (Å)	y (Å)	z (Å)
S1	0.000	0.000	-0.318
Cl2	0.000	0.000	2.006
F3	0.000	1.672	-0.313
F4	1.672	0.000	-0.313
F5	0.000	-1.672	-0.313
F6	-1.672	0.000	-0.313
F7	0.000	0.000	-1.974

	S1	Cl2	F3	F4	F5	F6	F7
S1		2.3235	1.6722	1.6722	1.6722	1.6722	1.6557
Cl2	2.3235		2.8584	2.8584	2.8584	2.8584	3.9792
F3	1.6722	2.8584		2.3648	3.3443	2.3648	2.3569
F4	1.6722	2.8584	2.3648		2.3648	3.3443	2.3569
F5	1.6722	2.8584	3.3443	2.3648		2.3648	2.3569
F6	1.6722	2.8584	2.3648	3.3443	2.3648		2.3569
F7	1.6557	3.9792	2.3569	2.3569	2.3569	2.3569

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	S1	F3	89.819	Cl2	S1	F4	89.819
Cl2	S1	F5	89.819	Cl2	S1	F6	89.819
Cl2	S1	F7	180.000	F3	S1	F4	89.999
F3	S1	F5	179.637	F3	S1	F6	89.999
F3	S1	F7	90.181	F4	S1	F5	89.999
F4	S1	F6	179.637	F4	S1	F7	90.181
F5	S1	F6	89.999	F5	S1	F7	90.181
F6	S1	F7	90.181

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

using model chemistry: SVWN/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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Number	Element	Mulliken
1	S	1.467
2	Cl	-0.156
3	F	-0.261
4	F	-0.261
5	F	-0.261
6	F	-0.261
7	F	-0.268

	x	y	z	Total
	0.000	0.000	-0.935	0.935
CHELPG
AIM
ESP

<r²>	241.409
(<r²>)^1/2	15.537

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

using model chemistry: SVWN/3-21G

States and conformations

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