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	hartrees
Energy at 0K	-588.722916
Energy at 298.15K	-588.723736
HF Energy	-588.722916
Nuclear repulsion energy	171.954812

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	763	754	68.30
2	A₁	368	364	51.50
3	E	891	881	192.30
3	E	891	881	192.29
4	E	258	256	10.67
4	E	258	256	10.67

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.383
F2	0.000	1.518	-0.198
F3	1.315	-0.759	-0.198
F4	-1.315	-0.759	-0.198

	Si1	F2	F3	F4
Si1		1.6255	1.6255	1.6255
F2	1.6255		2.6296	2.6296
F3	1.6255	2.6296		2.6296
F4	1.6255	2.6296	2.6296

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	Si1	F3	107.967		F2	Si1	F4	107.967
F3	Si1	F4	107.967

All results from a given calculation for SiF₃ (Silicon trifluoride radical)

using model chemistry: PBEPBEultrafine/6-31+G**

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	Si	0.646
2	F	-0.215
3	F	-0.215
4	F	-0.215

	x	y	z	Total
	0.000	0.000	1.358	1.358
CHELPG
AIM
ESP

	x	y	z
x	4.095	0.000	0.000
y	0.000	4.095	-0.000
z	0.000	-0.000	3.341

<r²>	82.973
(<r²>)^1/2	9.109

All results from a given calculation for SiF3 (Silicon trifluoride radical)

using model chemistry: PBEPBEultrafine/6-31+G**

States and conformations

All results from a given calculation for SiF₃ (Silicon trifluoride radical)