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	hartrees
Energy at 0K	-1708.314049
Energy at 298.15K	-1708.305899
HF Energy	-1707.150007
Nuclear repulsion energy	438.181505

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3190	3190	0.28
2	A₁	1455	1455	24.42
3	A₁	789	789	85.86
4	A₁	473	473	26.19
5	A₁	250	250	19.54
6	A₂	185	185	0.00
7	E	3278	3278	2.71
7	E	3278	3278	2.71
8	E	1584	1584	3.82
8	E	1584	1584	3.82
9	E	904	904	96.88
9	E	904	904	96.88
10	E	616	616	190.83
10	E	616	616	190.83
11	E	235	235	6.46
11	E	235	235	6.46
12	E	167	167	0.74
12	E	167	167	0.74

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.254
C2	0.000	0.000	2.111
Cl3	0.000	1.917	-0.464
Cl4	1.660	-0.959	-0.464
Cl5	-1.660	-0.959	-0.464
H6	0.000	-1.020	2.491
H7	0.883	0.510	2.491
H8	-0.883	0.510	2.491

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8576	2.0472	2.0472	2.0472	2.4585	2.4585	2.4585
C2	1.8576		3.2108	3.2108	3.2108	1.0880	1.0880	1.0880
Cl3	2.0472	3.2108		3.3206	3.3206	4.1662	3.3901	3.3901
Cl4	2.0472	3.2108	3.3206		3.3206	3.3901	3.3901	4.1662
Cl5	2.0472	3.2108	3.3206	3.3206		3.3901	4.1662	3.3901
H6	2.4585	1.0880	4.1662	3.3901	3.3901		1.7662	1.7662
H7	2.4585	1.0880	3.3901	3.3901	4.1662	1.7662		1.7662
H8	2.4585	1.0880	3.3901	4.1662	3.3901	1.7662	1.7662

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.411	Si1	C2	H7	110.411
Si1	C2	H8	110.411	C2	Si1	Cl3	110.533
C2	Si1	Cl4	110.533	C2	Si1	Cl5	110.533
Cl3	Si1	Cl4	108.389	Cl3	Si1	Cl5	108.389
Cl4	Si1	Cl5	108.389	H6	C2	H7	108.516
H6	C2	H8	108.516	H7	C2	H8	108.516

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: CBS-Q

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: CBS-Q

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)