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	hartrees
Energy at 0K	-328.678019
Energy at 298.15K	-328.672816
HF Energy	-328.525708
Nuclear repulsion energy	61.680818

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3087	2947	5.27
2	A₁	2198	2098	62.88
3	A₁	1412	1348	12.54
4	A₁	949	905	272.99
5	A₁	690	658	4.74
6	A₂	186	177	0.00
7	E	3169	3025	7.96
7	E	3169	3025	7.96
8	E	2199	2099	155.10
8	E	2199	2099	155.10
9	E	1566	1494	5.39
9	E	1566	1494	5.39
10	E	979	935	41.72
10	E	979	935	41.72
11	E	961	917	87.89
11	E	961	917	87.89
12	E	538	513	18.38
12	E	538	513	18.38

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.278
Si2	0.000	0.000	0.651
H3	0.000	-1.025	-1.662
H4	-0.888	0.513	-1.662
H5	0.888	0.513	-1.662
H6	0.000	1.406	1.178
H7	-1.218	-0.703	1.178
H8	1.218	-0.703	1.178

	C1	Si2	H3	H4	H5	H6	H7	H8
C1		1.9291	1.0951	1.0951	1.0951	2.8301	2.8301	2.8301
Si2	1.9291		2.5305	2.5305	2.5305	1.5018	1.5018	1.5018
H3	1.0951	2.5305		1.7761	1.7761	3.7390	3.1071	3.1071
H4	1.0951	2.5305	1.7761		1.7761	3.1071	3.1071	3.7390
H5	1.0951	2.5305	1.7761	1.7761		3.1071	3.7390	3.1071
H6	2.8301	1.5018	3.7390	3.1071	3.1071		2.4358	2.4358
H7	2.8301	1.5018	3.1071	3.1071	3.7390	2.4358		2.4358
H8	2.8301	1.5018	3.1071	3.7390	3.1071	2.4358	2.4358

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	Si2	H6	110.535	C1	Si2	H7	110.535
C1	Si2	H8	110.535	Si2	C1	H3	110.543
Si2	C1	H4	110.543	Si2	C1	H5	110.543
H3	C1	H4	108.378	H3	C1	H5	108.378
H4	C1	H5	108.378	H6	Si2	H7	108.387
H6	Si2	H8	108.387	H7	Si2	H8	108.387

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

using model chemistry: MP2/3-21G

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	ESP
1	C	-0.922	-0.658
2	Si	0.808	0.955
3	H	0.202	0.145
4	H	0.202	0.145
5	H	0.202	0.146
6	H	-0.164	-0.245
7	H	-0.164	-0.244
8	H	-0.164	-0.244

	x	y	z	Total
	0.000	0.000	-0.638	0.638
CHELPG
AIM
ESP	0.002	-0.003	-0.595	0.595

<r²>	52.403
(<r²>)^1/2	7.239

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

using model chemistry: MP2/3-21G

States and conformations

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