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	hartrees
Energy at 0K	-1708.230191
Energy at 298.15K	-1708.233517
HF Energy	-1707.319042
Nuclear repulsion energy	438.332128

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3069	2865	0.00
2	A₁	1318	1231	21.33
3	A₁	774	722	73.31
4	A₁	459	428	19.34
5	A₁	237	221	11.81
6	A₂	180	168	0.00
7	E	3162	2953	1.07
7	E	3162	2953	1.07
8	E	1472	1374	2.69
8	E	1472	1374	2.69
9	E	829	774	79.40
9	E	829	774	79.40
10	E	594	555	146.13
10	E	594	555	146.14
11	E	221	206	3.89
11	E	221	206	3.89
12	E	156	146	0.44
12	E	156	146	0.44

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.255
C2	0.000	0.000	2.104
Cl3	0.000	1.918	-0.463
Cl4	1.661	-0.959	-0.463
Cl5	-1.661	-0.959	-0.463
H6	0.000	-1.023	2.479
H7	0.886	0.512	2.479
H8	-0.886	0.512	2.479

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8491	2.0481	2.0481	2.0481	2.4478	2.4478	2.4478
C2	1.8491		3.2047	3.2047	3.2047	1.0895	1.0895	1.0895
Cl3	2.0481	3.2047		3.3221	3.3221	4.1600	3.3791	3.3791
Cl4	2.0481	3.2047	3.3221		3.3221	3.3791	3.3791	4.1600
Cl5	2.0481	3.2047	3.3221	3.3221		3.3791	4.1600	3.3791
H6	2.4478	1.0895	4.1600	3.3791	3.3791		1.7720	1.7720
H7	2.4478	1.0895	3.3791	3.3791	4.1600	1.7720		1.7720
H8	2.4478	1.0895	3.3791	4.1600	3.3791	1.7720	1.7720

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.111	Si1	C2	H7	110.111
Si1	C2	H8	110.111	C2	Si1	Cl3	110.530
C2	Si1	Cl4	110.530	C2	Si1	Cl5	110.530
Cl3	Si1	Cl4	108.392	Cl3	Si1	Cl5	108.392
Cl4	Si1	Cl5	108.392	H6	C2	H7	108.824
H6	C2	H8	108.824	H7	C2	H8	108.824

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: CCD/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: CCD/cc-pVTZ

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)