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	hartrees
Energy at 0K	-490.490229
Energy at 298.15K
HF Energy	-490.490229
Nuclear repulsion energy	117.928819

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	2280	2200	51.71	216.16	0.06	0.12
2	A₁	971	937	112.31	4.59	0.71	0.83
3	A₁	852	822	71.95	6.73	0.10	0.17
4	A₁	309	299	17.15	0.47	0.72	0.83
5	A₂	726	700	0.00	6.57	0.75	0.86
6	B₁	2293	2213	132.11	32.74	0.75	0.86
7	B₁	704	680	120.33	2.42	0.75	0.86
8	B₂	960	926	281.89	0.04	0.75	0.86
9	B₂	889	858	0.28	3.96	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.452
F2	0.000	1.291	-0.490
F3	0.000	-1.291	-0.490
H4	1.243	0.000	1.247
H5	-1.243	0.000	1.247

	Si1	F2	F3	H4	H5
Si1		1.5981	1.5981	1.4756	1.4756
F2	1.5981		2.5822	2.4960	2.4960
F3	1.5981	2.5822		2.4960	2.4960
H4	1.4756	2.4960	2.4960		2.4854
H5	1.4756	2.4960	2.4960	2.4854

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	F3	107.779	F2	Si1	H4	108.528
F2	Si1	H5	108.528	F3	Si1	H4	108.528
F3	Si1	H5	108.528	H4	Si1	H5	114.741

All results from a given calculation for SiH₂F₂ (difluorosilane)

using model chemistry: B3PW91/aug-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	1.278
2	F	-0.572
3	F	-0.572
4	H	-0.067
5	H	-0.067

	x	y	z	Total
	0.000	0.000	1.595	1.595
CHELPG
AIM
ESP

<r²>	58.464
(<r²>)^1/2	7.646

All results from a given calculation for SiH2F2 (difluorosilane)

using model chemistry: B3PW91/aug-cc-pVTZ

States and conformations

All results from a given calculation for SiH₂F₂ (difluorosilane)