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	hartrees
Energy at 0K	-489.156340
Energy at 298.15K
HF Energy	-489.156340
Nuclear repulsion energy	119.202232

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	2434	2211	65.09	159.14	0.11	0.19
2	A₁	1069	971	190.41	15.39	0.69	0.82
3	A₁	916	832	101.56	2.35	0.24	0.39
4	A₁	344	312	27.52	0.62	0.74	0.85
5	A₂	805	732	0.00	16.69	0.75	0.86
6	B₁	2433	2210	175.79	38.48	0.75	0.86
7	B₁	775	704	208.19	4.46	0.75	0.86
8	B₂	1067	969	417.24	4.77	0.75	0.86
9	B₂	966	878	17.47	5.99	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.451
F2	0.000	1.273	-0.489
F3	0.000	-1.273	-0.489
H4	1.227	0.000	1.242
H5	-1.227	0.000	1.242

	Si1	F2	F3	H4	H5
Si1		1.5820	1.5820	1.4599	1.4599
F2	1.5820		2.5453	2.4739	2.4739
F3	1.5820	2.5453		2.4739	2.4739
H4	1.4599	2.4739	2.4739		2.4541
H5	1.4599	2.4739	2.4739	2.4541

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	F3	107.120	F2	Si1	H4	108.771
F2	Si1	H5	108.771	F3	Si1	H4	108.771
F3	Si1	H5	108.771	H4	Si1	H5	114.393

All results from a given calculation for SiH₂F₂ (difluorosilane)

using model chemistry: HF/6-311G**

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	Si	1.467
2	F	-0.511
3	F	-0.511
4	H	-0.222
5	H	-0.222

	x	y	z	Total
	0.000	0.000	1.990	1.990
CHELPG
AIM
ESP

<r²>	57.586
(<r²>)^1/2	7.589

All results from a given calculation for SiH2F2 (difluorosilane)

using model chemistry: HF/6-311G**

States and conformations

All results from a given calculation for SiH₂F₂ (difluorosilane)