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	hartrees
Energy at 0K	-331.212072
Energy at 298.15K	-331.217988
Nuclear repulsion energy	62.814280

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3055	2933	4.94
2	A₁	2230	2141	66.38
3	A₁	1290	1238	17.58
4	A₁	936	899	226.52
5	A₁	706	678	10.12
6	A₂	197	189	0.00
7	E	3141	3016	7.66
7	E	3141	3016	7.66
8	E	2232	2143	138.90
8	E	2232	2143	138.91
9	E	1460	1402	4.92
9	E	1460	1402	4.92
10	E	955	917	39.35
10	E	955	917	39.35
11	E	886	851	71.82
11	E	886	851	71.83
12	E	518	497	9.99
12	E	518	497	9.98

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.242
Si2	0.000	0.000	0.633
H3	0.000	-1.019	-1.630
H4	-0.883	0.510	-1.630
H5	0.883	0.510	-1.630
H6	0.000	1.390	1.158
H7	-1.204	-0.695	1.158
H8	1.204	-0.695	1.158

	C1	Si2	H3	H4	H5	H6	H7	H8
C1		1.8748	1.0911	1.0911	1.0911	2.7734	2.7734	2.7734
Si2	1.8748		2.4826	2.4826	2.4826	1.4857	1.4857	1.4857
H3	1.0911	2.4826		1.7658	1.7658	3.6854	3.0547	3.0547
H4	1.0911	2.4826	1.7658		1.7658	3.0547	3.0547	3.6854
H5	1.0911	2.4826	1.7658	1.7658		3.0547	3.6854	3.0547
H6	2.7734	1.4857	3.6854	3.0547	3.0547		2.4073	2.4073
H7	2.7734	1.4857	3.0547	3.0547	3.6854	2.4073		2.4073
H8	2.7734	1.4857	3.0547	3.6854	3.0547	2.4073	2.4073

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	Si2	H6	110.700	C1	Si2	H7	110.700
C1	Si2	H8	110.700	Si2	C1	H3	110.873
Si2	C1	H4	110.873	Si2	C1	H5	110.873
H3	C1	H4	108.034	H3	C1	H5	108.034
H4	C1	H5	108.034	H6	Si2	H7	108.215
H6	Si2	H8	108.215	H7	Si2	H8	108.215

All results from a given calculation for CH₃SiH₃ (methyl silane)

using model chemistry: B1B95/6-311G**

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	C	-0.658
2	Si	0.561
3	H	0.151
4	H	0.151
5	H	0.151
6	H	-0.119
7	H	-0.119
8	H	-0.119

<r²>	50.181
(<r²>)^1/2	7.084

All results from a given calculation for CH3SiH3 (methyl silane)

using model chemistry: B1B95/6-311G**

States and conformations

All results from a given calculation for CH₃SiH₃ (methyl silane)