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	hartrees
Energy at 0K	-1699.900389
Energy at 298.15K	-1699.903843
HF Energy	-1699.285713
Nuclear repulsion energy	440.240319

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3021	2889	0.00
2	A₁	1409	1348	33.32
3	A₁	788	753	83.59
4	A₁	472	452	20.57
5	A₁	244	234	16.98
6	A₂	180	172	0.00
7	E	3099	2964	2.45
7	E	3099	2964	2.45
8	E	1530	1463	4.85
8	E	1530	1463	4.85
9	E	896	857	100.15
9	E	896	857	100.15
10	E	622	595	157.07
10	E	622	595	157.07
11	E	228	218	5.38
11	E	228	218	5.38
12	E	167	160	0.76
12	E	167	160	0.76

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.245
C2	0.000	0.000	2.103
Cl3	0.000	1.907	-0.461
Cl4	1.652	-0.954	-0.461
Cl5	-1.652	-0.954	-0.461
H6	0.000	-1.032	2.487
H7	0.893	0.516	2.487
H8	-0.893	0.516	2.487

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8582	2.0338	2.0338	2.0338	2.4682	2.4682	2.4682
C2	1.8582		3.1958	3.1958	3.1958	1.1008	1.1008	1.1008
Cl3	2.0338	3.1958		3.3036	3.3036	4.1629	3.3804	3.3804
Cl4	2.0338	3.1958	3.3036		3.3036	3.3804	3.3804	4.1629
Cl5	2.0338	3.1958	3.3036	3.3036		3.3804	4.1629	3.3804
H6	2.4682	1.1008	4.1629	3.3804	3.3804		1.7868	1.7868
H7	2.4682	1.1008	3.3804	3.3804	4.1629	1.7868		1.7868
H8	2.4682	1.1008	3.3804	4.1629	3.3804	1.7868	1.7868

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.419	Si1	C2	H7	110.419
Si1	C2	H8	110.419	C2	Si1	Cl3	110.314
C2	Si1	Cl4	110.314	C2	Si1	Cl5	110.314
Cl3	Si1	Cl4	108.616	Cl3	Si1	Cl5	108.616
Cl4	Si1	Cl5	108.616	H6	C2	H7	108.507
H6	C2	H8	108.507	H7	C2	H8	108.507

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: CCD/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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All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: CCD/3-21G*

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)