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	hartrees
Energy at 0K	-487.658897
Energy at 298.15K
HF Energy	-487.658897
Nuclear repulsion energy	118.300460

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	2351	2258	74.02	123.90	0.11	0.20
2	A₁	1004	965	202.38	16.50	0.48	0.65
3	A₁	922	885	2.44	8.23	0.58	0.74
4	A₁	335	322	18.69	0.77	0.75	0.86
5	A₂	774	744	0.00	14.36	0.75	0.86
6	B₁	2355	2262	198.58	32.93	0.75	0.86
7	B₁	748	719	156.41	5.39	0.75	0.86
8	B₂	1115	1071	287.25	1.43	0.75	0.86
9	B₂	957	919	14.45	9.32	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.453
F2	0.000	1.281	-0.494
F3	0.000	-1.281	-0.494
H4	1.231	0.000	1.272
H5	-1.231	0.000	1.272

	Si1	F2	F3	H4	H5
Si1		1.5928	1.5928	1.4786	1.4786
F2	1.5928		2.5613	2.5047	2.5047
F3	1.5928	2.5613		2.5047	2.5047
H4	1.4786	2.5047	2.5047		2.4626
H5	1.4786	2.5047	2.5047	2.4626

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	F3	107.038	F2	Si1	H4	109.219
F2	Si1	H5	109.219	F3	Si1	H4	109.219
F3	Si1	H5	109.219	H4	Si1	H5	112.765

All results from a given calculation for SiH₂F₂ (difluorosilane)

using model chemistry: PBE1PBE/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	Si	0.856
2	F	-0.304
3	F	-0.304
4	H	-0.124
5	H	-0.124

	x	y	z	Total
	0.000	0.000	1.325	1.325
CHELPG
AIM
ESP

<r²>	57.821
(<r²>)^1/2	7.604

All results from a given calculation for SiH2F2 (difluorosilane)

using model chemistry: PBE1PBE/3-21G

States and conformations

All results from a given calculation for SiH₂F₂ (difluorosilane)