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	hartrees
Energy at 0K	-490.630867
Energy at 298.15K
HF Energy	-490.630867
Nuclear repulsion energy	118.241883

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	2302	2302	54.20	195.04	0.07	0.13
2	A₁	989	989	119.17	5.52	0.71	0.83
3	A₁	855	855	65.46	5.80	0.11	0.21
4	A₁	311	311	16.46	0.53	0.72	0.84
5	A₂	733	733	0.00	7.25	0.75	0.86
6	B₁	2312	2312	139.90	32.17	0.75	0.86
7	B₁	707	707	121.60	3.02	0.75	0.86
8	B₂	975	975	280.42	0.01	0.75	0.86
9	B₂	894	894	0.84	4.30	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.450
F2	0.000	1.289	-0.488
F3	0.000	-1.289	-0.488
H4	1.237	0.000	1.244
H5	-1.237	0.000	1.244

	Si1	F2	F3	H4	H5
Si1		1.5939	1.5939	1.4701	1.4701
F2	1.5939		2.5774	2.4882	2.4882
F3	1.5939	2.5774		2.4882	2.4882
H4	1.4701	2.4882	2.4882		2.4749
H5	1.4701	2.4882	2.4882	2.4749

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	F3	107.896	F2	Si1	H4	108.526
F2	Si1	H5	108.526	F3	Si1	H4	108.526
F3	Si1	H5	108.526	H4	Si1	H5	114.647

All results from a given calculation for SiH₂F₂ (difluorosilane)

using model chemistry: TPSSh/cc-pVQZ

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	0.975
2	F	-0.341
3	F	-0.341
4	H	-0.146
5	H	-0.146

	x	y	z	Total
	0.000	0.000	1.470	1.470
CHELPG
AIM
ESP

<r²>	58.169
(<r²>)^1/2	7.627

All results from a given calculation for SiH2F2 (difluorosilane)

using model chemistry: TPSSh/cc-pVQZ

States and conformations

All results from a given calculation for SiH₂F₂ (difluorosilane)