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	hartrees
Energy at 0K	-291.131701
Energy at 298.15K
HF Energy	-291.073530
Nuclear repulsion energy	15.671784

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	2224	2134	8.35	294.77	0.06	0.11
2	A₁	772	741	66.05	22.20	0.17	0.29
3	E	2263	2171	117.56	73.82	0.75	0.86
3	E	2263	2171	117.57	73.78	0.75	0.86
4	E	944	906	63.43	6.41	0.75	0.86
4	E	944	906	63.43	6.42	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.080
H2	0.000	1.409	-0.373
H3	1.220	-0.704	-0.373
H4	-1.220	-0.704	-0.373

	Si1	H2	H3	H4
Si1		1.4796	1.4796	1.4796
H2	1.4796		2.4399	2.4399
H3	1.4796	2.4399		2.4399
H4	1.4796	2.4399	2.4399

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	Si1	H3	111.080		H2	Si1	H4	111.080
H3	Si1	H4	111.080

All results from a given calculation for SiH₃ (Silyl radical)

using model chemistry: B2PLYP=FULLultrafine/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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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	0.355
2	H	-0.118
3	H	-0.118
4	H	-0.118

	x	y	z	Total
	0.000	0.000	0.043	0.043
CHELPG
AIM
ESP

<r²>	16.543
(<r²>)^1/2	4.067

All results from a given calculation for SiH3 (Silyl radical)

using model chemistry: B2PLYP=FULLultrafine/aug-cc-pVTZ

States and conformations

All results from a given calculation for SiH₃ (Silyl radical)