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	hartrees
Energy at 0K	-331.139066
Energy at 298.15K	-331.144896
HF Energy	-331.139066
Nuclear repulsion energy	62.061569

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2978	2953	6.55
2	A₁	2171	2153	73.27
3	A₁	1295	1285	8.40
4	A₁	924	916	205.88
5	A₁	665	659	7.62
6	A₂	191	189	0.00
7	E	3049	3025	12.31
7	E	3049	3025	12.31
8	E	2179	2161	171.72
8	E	2179	2161	171.74
9	E	1463	1451	2.54
9	E	1463	1451	2.54
10	E	935	927	37.90
10	E	935	927	37.90
11	E	882	875	65.74
11	E	882	875	65.73
12	E	508	504	7.57
12	E	508	504	7.57

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.259
Si2	0.000	0.000	0.642
H3	0.000	-1.029	-1.654
H4	-0.891	0.515	-1.654
H5	0.891	0.515	-1.654
H6	0.000	1.401	1.176
H7	-1.214	-0.701	1.176
H8	1.214	-0.701	1.176

	C1	Si2	H3	H4	H5	H6	H7	H8
C1		1.9007	1.1024	1.1024	1.1024	2.8090	2.8090	2.8090
Si2	1.9007		2.5160	2.5160	2.5160	1.4996	1.4996	1.4996
H3	1.1024	2.5160		1.7825	1.7825	3.7301	3.0964	3.0964
H4	1.1024	2.5160	1.7825		1.7825	3.0964	3.0964	3.7301
H5	1.1024	2.5160	1.7825	1.7825		3.0964	3.7301	3.0964
H6	2.8090	1.4996	3.7301	3.0964	3.0964		2.4273	2.4273
H7	2.8090	1.4996	3.0964	3.0964	3.7301	2.4273		2.4273
H8	2.8090	1.4996	3.0964	3.7301	3.0964	2.4273	2.4273

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	Si2	H6	110.849	C1	Si2	H7	110.849
C1	Si2	H8	110.849	Si2	C1	H3	111.005
Si2	C1	H4	111.005	Si2	C1	H5	111.005
H3	C1	H4	107.895	H3	C1	H5	107.895
H4	C1	H5	107.895	H6	Si2	H7	108.059
H6	Si2	H8	108.059	H7	Si2	H8	108.059

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

using model chemistry: BLYP/6-31G*

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	C	-0.600
2	Si	0.296
3	H	0.159
4	H	0.159
5	H	0.159
6	H	-0.058
7	H	-0.058
8	H	-0.058

<r²>	50.999
(<r²>)^1/2	7.141

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

using model chemistry: BLYP/6-31G*

States and conformations

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