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	hartrees
Energy at 0K	-490.501550
Energy at 298.15K
HF Energy	-490.501550
Nuclear repulsion energy	118.542198

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	2278	2278	53.47	187.53	0.08	0.16
2	A₁	979	979	121.80	7.45	0.70	0.82
3	A₁	863	863	67.91	5.07	0.16	0.28
4	A₁	315	315	17.11	0.61	0.73	0.84
5	A₂	727	727	0.00	9.42	0.75	0.86
6	B₁	2290	2290	141.88	34.18	0.75	0.86
7	B₁	707	707	127.20	3.78	0.75	0.86
8	B₂	976	976	290.28	0.03	0.75	0.86
9	B₂	895	895	0.22	5.58	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.447
F2	0.000	1.286	-0.486
F3	0.000	-1.286	-0.486
H4	1.239	0.000	1.243
H5	-1.239	0.000	1.243

	Si1	F2	F3	H4	H5
Si1		1.5887	1.5887	1.4729	1.4729
F2	1.5887		2.5718	2.4858	2.4858
F3	1.5887	2.5718		2.4858	2.4858
H4	1.4729	2.4858	2.4858		2.4785
H5	1.4729	2.4858	2.4858	2.4785

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	F3	108.075	F2	Si1	H4	108.507
F2	Si1	H5	108.507	F3	Si1	H4	108.507
F3	Si1	H5	108.507	H4	Si1	H5	114.564

All results from a given calculation for SiH₂F₂ (difluorosilane)

using model chemistry: B3PW91/Def2TZVPP

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	0.751
2	F	-0.302
3	F	-0.302
4	H	-0.074
5	H	-0.074

	x	y	z	Total
	0.000	0.000	1.470	1.470
CHELPG
AIM
ESP

<r²>	57.944
(<r²>)^1/2	7.612

All results from a given calculation for SiH2F2 (difluorosilane)

using model chemistry: B3PW91/Def2TZVPP

States and conformations

All results from a given calculation for SiH₂F₂ (difluorosilane)