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	hartrees
Energy at 0K	-488.848727
Energy at 298.15K
HF Energy	-488.848727
Nuclear repulsion energy	118.877579

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	2214	2214	41.10	237.58	0.07	0.13
2	A₁	932	932	112.00	5.03	0.60	0.75
3	A₁	856	856	49.70	7.74	0.13	0.24
4	A₁	302	302	15.48	0.52	0.72	0.84
5	A₂	693	693	0.00	7.66	0.75	0.86
6	B₁	2232	2232	110.91	35.50	0.75	0.86
7	B₁	679	679	105.56	2.99	0.75	0.86
8	B₂	959	959	235.12	0.71	0.75	0.86
9	B₂	860	860	11.65	3.58	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.447
F2	0.000	1.279	-0.486
F3	0.000	-1.279	-0.486
H4	1.252	0.000	1.239
H5	-1.252	0.000	1.239

	Si1	F2	F3	H4	H5
Si1		1.5829	1.5829	1.4818	1.4818
F2	1.5829		2.5578	2.4857	2.4857
F3	1.5829	2.5578		2.4857	2.4857
H4	1.4818	2.4857	2.4857		2.5049
H5	1.4818	2.4857	2.4857	2.5049

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	F3	107.793	F2	Si1	H4	108.354
F2	Si1	H5	108.354	F3	Si1	H4	108.354
F3	Si1	H5	108.354	H4	Si1	H5	115.393

All results from a given calculation for SiH₂F₂ (difluorosilane)

using model chemistry: LSDA/aug-cc-pV(T+d)Z

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	1.266
2	F	-0.521
3	F	-0.521
4	H	-0.112
5	H	-0.112

	x	y	z	Total
	0.000	0.000	1.475	1.475
CHELPG
AIM
ESP

<r²>	57.810
(<r²>)^1/2	7.603

All results from a given calculation for SiH2F2 (difluorosilane)

using model chemistry: LSDA/aug-cc-pV(T+d)Z

States and conformations

All results from a given calculation for SiH₂F₂ (difluorosilane)