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	hartrees
Energy at 0K	-1708.406883
Energy at 298.15K	-1708.410248
HF Energy	-1707.319023
Nuclear repulsion energy	439.520084

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3083	2923	0.00
2	A₁	1325	1256	22.75
3	A₁	781	740	72.61
4	A₁	463	439	18.76
5	A₁	237	225	11.62
6	A₂	194	184	0.00
7	E	3156	2992	1.23
7	E	3156	2992	1.23
8	E	1483	1406	2.76
8	E	1483	1406	2.76
9	E	830	787	80.47
9	E	830	787	80.47
10	E	601	570	143.13
10	E	601	570	143.14
11	E	221	210	3.97
11	E	221	210	3.97
12	E	157	149	0.40
12	E	157	149	0.40

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.254
C2	0.000	0.000	2.096
Cl3	0.000	1.914	-0.462
Cl4	1.657	-0.957	-0.462
Cl5	-1.657	-0.957	-0.462
H6	0.000	-1.021	2.468
H7	0.884	0.510	2.468
H8	-0.884	0.510	2.468

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8418	2.0430	2.0430	2.0430	2.4374	2.4374	2.4374
C2	1.8418		3.1941	3.1941	3.1941	1.0861	1.0861	1.0861
Cl3	2.0430	3.1941		3.3145	3.3145	4.1460	3.3661	3.3661
Cl4	2.0430	3.1941	3.3145		3.3145	3.3661	3.3661	4.1460
Cl5	2.0430	3.1941	3.3145	3.3145		3.3661	4.1460	3.3661
H6	2.4374	1.0861	4.1460	3.3661	3.3661		1.7676	1.7676
H7	2.4374	1.0861	3.3661	3.3661	4.1460	1.7676		1.7676
H8	2.4374	1.0861	3.3661	4.1460	3.3661	1.7676	1.7676

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.012	Si1	C2	H7	110.012
Si1	C2	H8	110.012	C2	Si1	Cl3	110.505
C2	Si1	Cl4	110.505	C2	Si1	Cl5	110.505
Cl3	Si1	Cl4	108.418	Cl3	Si1	Cl5	108.418
Cl4	Si1	Cl5	108.418	H6	C2	H7	108.925
H6	C2	H8	108.925	H7	C2	H8	108.925

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: CCSD=FULL/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: CCSD=FULL/cc-pVTZ

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)