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	hartrees
Energy at 0K	-331.215462
Energy at 298.15K	-331.210215
Nuclear repulsion energy	62.726164

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3060	2920	6.65
2	A₁	2228	2127	67.79
3	A₁	1323	1262	21.91
4	A₁	944	901	232.90
5	A₁	707	675	9.05
6	A₂	191	182	0.00
7	E	3141	2998	9.73
7	E	3141	2998	9.73
8	E	2227	2126	143.32
8	E	2227	2126	143.35
9	E	1488	1421	6.54
9	E	1488	1421	6.54
10	E	960	916	42.59
10	E	960	916	42.58
11	E	901	860	76.17
11	E	901	860	76.17
12	E	524	500	10.58
12	E	524	500	10.58

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.242
Si2	0.000	0.000	0.634
H3	0.000	-1.018	-1.637
H4	-0.882	0.509	-1.637
H5	0.882	0.509	-1.637
H6	0.000	1.392	1.161
H7	-1.205	-0.696	1.161
H8	1.205	-0.696	1.161

	C1	Si2	H3	H4	H5	H6	H7	H8
C1		1.8764	1.0922	1.0922	1.0922	2.7775	2.7775	2.7775
Si2	1.8764		2.4891	2.4891	2.4891	1.4884	1.4884	1.4884
H3	1.0922	2.4891		1.7637	1.7637	3.6933	3.0640	3.0640
H4	1.0922	2.4891	1.7637		1.7637	3.0640	3.0640	3.6933
H5	1.0922	2.4891	1.7637	1.7637		3.0640	3.6933	3.0640
H6	2.7775	1.4884	3.6933	3.0640	3.0640		2.4109	2.4109
H7	2.7775	1.4884	3.0640	3.0640	3.6933	2.4109		2.4109
H8	2.7775	1.4884	3.0640	3.6933	3.0640	2.4109	2.4109

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	Si2	H6	110.741	C1	Si2	H7	110.741
C1	Si2	H8	110.741	Si2	C1	H3	111.200
Si2	C1	H4	111.200	Si2	C1	H5	111.200
H3	C1	H4	107.689	H3	C1	H5	107.689
H4	C1	H5	107.689	H6	Si2	H7	108.172
H6	Si2	H8	108.172	H7	Si2	H8	108.172

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

using model chemistry: mPW1PW91/6-311G*

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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Number	Element	Mulliken
1	C	-0.997
2	Si	0.456
3	H	0.250
4	H	0.250
5	H	0.250
6	H	-0.069
7	H	-0.069
8	H	-0.069

<r²>	50.318
(<r²>)^1/2	7.094

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

using model chemistry: mPW1PW91/6-311G*

States and conformations

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