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	hartrees
Energy at 0K	-329.400945
Energy at 298.15K	-329.395701
Nuclear repulsion energy	61.899174

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3062	2943	4.97
2	A₁	2174	2090	64.87
3	A₁	1364	1311	20.03
4	A₁	910	874	205.06
5	A₁	695	668	4.19
6	A₂	177	170	0.00
7	E	3148	3026	6.19
7	E	3148	3026	6.19
8	E	2183	2099	149.36
8	E	2183	2099	149.37
9	E	1529	1470	8.15
9	E	1529	1470	8.15
10	E	952	915	1.66
10	E	952	915	1.66
11	E	928	892	105.92
11	E	928	892	105.92
12	E	529	509	12.19
12	E	529	509	12.19

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.269
Si2	0.000	0.000	0.645
H3	0.000	-1.027	-1.653
H4	-0.889	0.513	-1.653
H5	0.889	0.513	-1.653
H6	0.000	1.404	1.180
H7	-1.216	-0.702	1.180
H8	1.216	-0.702	1.180

	C1	Si2	H3	H4	H5	H6	H7	H8
C1		1.9148	1.0959	1.0959	1.0959	2.8231	2.8231	2.8231
Si2	1.9148		2.5170	2.5170	2.5170	1.5023	1.5023	1.5023
H3	1.0959	2.5170		1.7783	1.7783	3.7325	3.0995	3.0995
H4	1.0959	2.5170	1.7783		1.7783	3.0995	3.0995	3.7325
H5	1.0959	2.5170	1.7783	1.7783		3.0995	3.7325	3.0995
H6	2.8231	1.5023	3.7325	3.0995	3.0995		2.4320	2.4320
H7	2.8231	1.5023	3.0995	3.0995	3.7325	2.4320		2.4320
H8	2.8231	1.5023	3.0995	3.7325	3.0995	2.4320	2.4320

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	Si2	H6	110.837	C1	Si2	H7	110.837
C1	Si2	H8	110.837	Si2	C1	H3	110.472
Si2	C1	H4	110.472	Si2	C1	H5	110.472
H3	C1	H4	108.452	H3	C1	H5	108.452
H4	C1	H5	108.452	H6	Si2	H7	108.072
H6	Si2	H8	108.072	H7	Si2	H8	108.072

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

using model chemistry: B3PW91/3-21G

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	-0.992
2	Si	0.630
3	H	0.234
4	H	0.234
5	H	0.234
6	H	-0.114
7	H	-0.114
8	H	-0.114

<r²>	51.511
(<r²>)^1/2	7.177

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

using model chemistry: B3PW91/3-21G

States and conformations

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