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	hartrees
Energy at 0K	-490.556684
Energy at 298.15K
HF Energy	-490.556684
Nuclear repulsion energy	118.194809

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	2293	2293	51.33	213.14	0.06	0.12
2	A₁	975	975	115.22	4.43	0.70	0.82
3	A₁	859	859	71.66	6.66	0.09	0.17
4	A₁	310	310	17.42	0.43	0.72	0.84
5	A₂	728	728	0.00	6.44	0.75	0.86
6	B₁	2306	2306	130.58	31.85	0.75	0.86
7	B₁	709	709	122.91	2.29	0.75	0.86
8	B₂	968	968	285.19	0.04	0.75	0.86
9	B₂	896	896	0.04	3.83	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.451
F2	0.000	1.288	-0.489
F3	0.000	-1.288	-0.489
H4	1.241	0.000	1.246
H5	-1.241	0.000	1.246

	Si1	F2	F3	H4	H5
Si1		1.5943	1.5943	1.4740	1.4740
F2	1.5943		2.5758	2.4916	2.4916
F3	1.5943	2.5758		2.4916	2.4916
H4	1.4740	2.4916	2.4916		2.4826
H5	1.4740	2.4916	2.4916	2.4826

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	F3	107.765	F2	Si1	H4	108.534
F2	Si1	H5	108.534	F3	Si1	H4	108.534
F3	Si1	H5	108.534	H4	Si1	H5	114.734

All results from a given calculation for SiH₂F₂ (difluorosilane)

using model chemistry: mPW1PW91/daug-cc-pVTZ

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	1.713
2	F	-0.858
3	F	-0.858
4	H	0.001
5	H	0.001

	x	y	z	Total
	0.000	0.000	1.591	1.591
CHELPG
AIM
ESP

<r²>	58.255
(<r²>)^1/2	7.632

All results from a given calculation for SiH2F2 (difluorosilane)

using model chemistry: mPW1PW91/daug-cc-pVTZ

States and conformations

All results from a given calculation for SiH₂F₂ (difluorosilane)