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	hartrees
Energy at 0K	-1708.254103
Energy at 298.15K	-1708.257381
HF Energy	-1707.320900
Nuclear repulsion energy	437.928779

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3056	2941	0.01
2	A₁	1317	1268	20.51
3	A₁	771	742	64.88
4	A₁	454	437	17.84
5	A₁	233	224	10.86
6	A₂	171	164	0.00
7	E	3147	3029	1.22
7	E	3147	3029	1.22
8	E	1475	1419	2.79
8	E	1475	1419	2.79
9	E	832	801	72.25
9	E	832	801	72.25
10	E	587	565	141.36
10	E	587	565	141.38
11	E	217	209	3.71
11	E	217	209	3.71
12	E	154	148	0.42
12	E	154	148	0.42

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.259
C2	0.000	0.000	2.108
Cl3	0.000	1.919	-0.465
Cl4	1.662	-0.959	-0.465
Cl5	-1.662	-0.959	-0.465
H6	0.000	-1.026	2.480
H7	0.888	0.513	2.480
H8	-0.888	0.513	2.480

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8491	2.0508	2.0508	2.0508	2.4459	2.4459	2.4459
C2	1.8491		3.2099	3.2099	3.2099	1.0907	1.0907	1.0907
Cl3	2.0508	3.2099		3.3233	3.3233	4.1641	3.3819	3.3819
Cl4	2.0508	3.2099	3.3233		3.3233	3.3819	3.3819	4.1641
Cl5	2.0508	3.2099	3.3233	3.3233		3.3819	4.1641	3.3819
H6	2.4459	1.0907	4.1641	3.3819	3.3819		1.7762	1.7762
H7	2.4459	1.0907	3.3819	3.3819	4.1641	1.7762		1.7762
H8	2.4459	1.0907	3.3819	4.1641	3.3819	1.7762	1.7762

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	109.910	Si1	C2	H7	109.910
Si1	C2	H8	109.910	C2	Si1	Cl3	110.678
C2	Si1	Cl4	110.678	C2	Si1	Cl5	110.678
Cl3	Si1	Cl4	108.238	Cl3	Si1	Cl5	108.238
Cl4	Si1	Cl5	108.238	H6	C2	H7	109.029
H6	C2	H8	109.029	H7	C2	H8	109.029

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: QCISD/aug-cc-pVTZ

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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All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: QCISD/aug-cc-pVTZ

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)