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	hartrees
Energy at 0K	-331.176155
Energy at 298.15K	-331.170955
Nuclear repulsion energy	62.191978

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2960	2952	9.68
2	A₁	2159	2153	70.23
3	A₁	1292	1289	12.37
4	A₁	923	921	227.31
5	A₁	669	667	9.55
6	A₂	186	186	0.00
7	E	3025	3017	15.41
7	E	3025	3017	15.41
8	E	2161	2155	147.95
8	E	2161	2155	147.98
9	E	1455	1452	4.90
9	E	1455	1452	4.90
10	E	939	937	42.27
10	E	939	937	42.27
11	E	883	880	67.31
11	E	883	880	67.31
12	E	515	514	11.06
12	E	515	514	11.06

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.256
Si2	0.000	0.000	0.642
H3	0.000	-1.025	-1.654
H4	-0.888	0.513	-1.654
H5	0.888	0.513	-1.654
H6	0.000	1.399	1.171
H7	-1.211	-0.699	1.171
H8	1.211	-0.699	1.171

	C1	Si2	H3	H4	H5	H6	H7	H8
C1		1.8974	1.0999	1.0999	1.0999	2.8010	2.8010	2.8010
Si2	1.8974		2.5145	2.5145	2.5145	1.4954	1.4954	1.4954
H3	1.0999	2.5145		1.7756	1.7756	3.7226	3.0914	3.0914
H4	1.0999	2.5145	1.7756		1.7756	3.0914	3.0914	3.7226
H5	1.0999	2.5145	1.7756	1.7756		3.0914	3.7226	3.0914
H6	2.8010	1.4954	3.7226	3.0914	3.0914		2.4223	2.4223
H7	2.8010	1.4954	3.0914	3.0914	3.7226	2.4223		2.4223
H8	2.8010	1.4954	3.0914	3.7226	3.0914	2.4223	2.4223

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	Si2	H6	110.737	C1	Si2	H7	110.737
C1	Si2	H8	110.737	Si2	C1	H3	111.248
Si2	C1	H4	111.248	Si2	C1	H5	111.248
H3	C1	H4	107.637	H3	C1	H5	107.637
H4	C1	H5	107.637	H6	Si2	H7	108.176
H6	Si2	H8	108.176	H7	Si2	H8	108.176

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

using model chemistry: BLYP/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	-0.903
2	Si	0.488
3	H	0.221
4	H	0.221
5	H	0.221
6	H	-0.082
7	H	-0.082
8	H	-0.082

<r²>	51.273
(<r²>)^1/2	7.160

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

using model chemistry: BLYP/6-311G*

States and conformations

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