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	hartrees
Energy at 0K	-490.546088
Energy at 298.15K
HF Energy	-490.546088
Nuclear repulsion energy	118.779199

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	2270	2270	53.65	209.96	0.06	0.11
2	A₁	989	989	119.36	4.03	0.72	0.83
3	A₁	866	866	74.58	5.94	0.10	0.18
4	A₁	317	317	17.41	0.41	0.71	0.83
5	A₂	738	738	0.00	5.85	0.75	0.86
6	B₁	2275	2275	140.73	30.43	0.75	0.86
7	B₁	715	715	126.76	2.09	0.75	0.86
8	B₂	976	976	295.36	0.02	0.75	0.86
9	B₂	903	903	0.52	3.58	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.447
F2	0.000	1.283	-0.486
F3	0.000	-1.283	-0.486
H4	1.235	0.000	1.242
H5	-1.235	0.000	1.242

	Si1	F2	F3	H4	H5
Si1		1.5857	1.5857	1.4694	1.4694
F2	1.5857		2.5654	2.4813	2.4813
F3	1.5857	2.5654		2.4813	2.4813
H4	1.4694	2.4813	2.4813		2.4707
H5	1.4694	2.4813	2.4813	2.4707

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	F3	107.976	F2	Si1	H4	108.563
F2	Si1	H5	108.563	F3	Si1	H4	108.563
F3	Si1	H5	108.563	H4	Si1	H5	114.437

All results from a given calculation for SiH₂F₂ (difluorosilane)

using model chemistry: wB97X-D/aug-cc-pV(T+d)Z

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	1.389
2	F	-0.598
3	F	-0.598
4	H	-0.097
5	H	-0.097

	x	y	z	Total
	0.000	0.000	1.513	1.513
CHELPG
AIM
ESP

<r²>	57.827
(<r²>)^1/2	7.604

All results from a given calculation for SiH2F2 (difluorosilane)

using model chemistry: wB97X-D/aug-cc-pV(T+d)Z

States and conformations

All results from a given calculation for SiH₂F₂ (difluorosilane)