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	hartrees
Energy at 0K	-331.198723
Energy at 298.15K	-331.204580
HF Energy	-331.198723
Nuclear repulsion energy	62.219158

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2987	2944	9.29
2	A₁	2159	2128	70.63
3	A₁	1274	1256	10.14
4	A₁	917	904	212.87
5	A₁	667	657	11.02
6	A₂	188	185	0.00
7	E	3067	3023	12.02
7	E	3067	3023	12.02
8	E	2164	2133	148.58
8	E	2164	2133	148.57
9	E	1444	1423	3.91
9	E	1444	1423	3.91
10	E	937	924	37.78
10	E	937	924	37.77
11	E	876	864	60.25
11	E	876	864	60.25
12	E	514	506	10.29
12	E	514	506	10.29

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.257
Si2	0.000	0.000	0.641
H3	0.000	-1.024	-1.647
H4	-0.887	0.512	-1.647
H5	0.887	0.512	-1.647
H6	0.000	1.402	1.168
H7	-1.214	-0.701	1.168
H8	1.214	-0.701	1.168

	C1	Si2	H3	H4	H5	H6	H7	H8
C1		1.8986	1.0958	1.0958	1.0958	2.8011	2.8011	2.8011
Si2	1.8986		2.5072	2.5072	2.5072	1.4973	1.4973	1.4973
H3	1.0958	2.5072		1.7738	1.7738	3.7160	3.0826	3.0826
H4	1.0958	2.5072	1.7738		1.7738	3.0826	3.0826	3.7160
H5	1.0958	2.5072	1.7738	1.7738		3.0826	3.7160	3.0826
H6	2.8011	1.4973	3.7160	3.0826	3.0826		2.4278	2.4278
H7	2.8011	1.4973	3.0826	3.0826	3.7160	2.4278		2.4278
H8	2.8011	1.4973	3.0826	3.7160	3.0826	2.4278	2.4278

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	Si2	H6	110.587	C1	Si2	H7	110.587
C1	Si2	H8	110.587	Si2	C1	H3	110.842
Si2	C1	H4	110.842	Si2	C1	H5	110.842
H3	C1	H4	108.066	H3	C1	H5	108.066
H4	C1	H5	108.066	H6	Si2	H7	108.333
H6	Si2	H8	108.333	H7	Si2	H8	108.333

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

using model chemistry: B97D3/TZVP

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	-0.499
2	Si	0.402
3	H	0.128
4	H	0.128
5	H	0.128
6	H	-0.096
7	H	-0.096
8	H	-0.096

<r²>	51.026
(<r²>)^1/2	7.143

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

using model chemistry: B97D3/TZVP

States and conformations

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