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	hartrees
Energy at 0K	-490.260562
Energy at 298.15K
HF Energy	-490.260562
Nuclear repulsion energy	117.179211

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	2286	2194	51.10	187.63	0.11	0.19
2	A₁	960	922	130.08	12.93	0.68	0.81
3	A₁	847	812	78.27	5.10	0.19	0.32
4	A₁	302	290	19.61	1.10	0.73	0.85
5	A₂	709	681	0.00	18.17	0.75	0.86
6	B₁	2303	2210	136.04	41.11	0.75	0.86
7	B₁	697	669	136.76	5.77	0.75	0.86
8	B₂	956	917	326.98	1.10	0.75	0.86
9	B₂	880	845	0.00	10.68	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.457
F2	0.000	1.299	-0.494
F3	0.000	-1.299	-0.494
H4	1.250	0.000	1.247
H5	-1.250	0.000	1.247

	Si1	F2	F3	H4	H5
Si1		1.6097	1.6097	1.4787	1.4787
F2	1.6097		2.5972	2.5063	2.5063
F3	1.6097	2.5972		2.5063	2.5063
H4	1.4787	2.5063	2.5063		2.4996
H5	1.4787	2.5063	2.5063	2.4996

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	F3	107.559	F2	Si1	H4	108.411
F2	Si1	H5	108.411	F3	Si1	H4	108.411
F3	Si1	H5	108.411	H4	Si1	H5	115.380

All results from a given calculation for SiH₂F₂ (difluorosilane)

using model chemistry: PBE1PBE/TZVP

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	0.819
2	F	-0.318
3	F	-0.318
4	H	-0.091
5	H	-0.091

	x	y	z	Total
	0.000	0.000	1.832	1.832
CHELPG
AIM
ESP

<r²>	59.042
(<r²>)^1/2	7.684

All results from a given calculation for SiH2F2 (difluorosilane)

using model chemistry: PBE1PBE/TZVP

States and conformations

All results from a given calculation for SiH₂F₂ (difluorosilane)