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	hartrees
Energy at 0K	-1710.063872
Energy at 298.15K	-1710.066919
HF Energy	-1710.063872
Nuclear repulsion energy	430.604050

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2979	2963	0.53
2	A₁	1274	1267	14.78
3	A₁	715	712	69.66
4	A₁	412	410	21.70
5	A₁	221	220	11.77
6	A₂	166	165	0.00
7	E	3065	3049	1.44
7	E	3065	3049	1.45
8	E	1424	1417	4.29
8	E	1424	1417	4.29
9	E	819	814	74.81
9	E	819	814	74.81
10	E	538	536	156.91
10	E	538	536	156.93
11	E	210	209	2.88
11	E	210	209	2.89
12	E	148	147	0.67
12	E	148	147	0.67

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.260
C2	0.000	0.000	2.134
Cl3	0.000	1.955	-0.470
Cl4	1.693	-0.978	-0.470
Cl5	-1.693	-0.978	-0.470
H6	0.000	-1.034	2.511
H7	0.896	0.517	2.511
H8	-0.896	0.517	2.511

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8739	2.0870	2.0870	2.0870	2.4777	2.4777	2.4777
C2	1.8739		3.2562	3.2562	3.2562	1.1011	1.1011	1.1011
Cl3	2.0870	3.2562		3.3866	3.3866	4.2221	3.4292	3.4292
Cl4	2.0870	3.2562	3.3866		3.3866	3.4292	3.4292	4.2221
Cl5	2.0870	3.2562	3.3866	3.3866		3.4292	4.2221	3.4292
H6	2.4777	1.1011	4.2221	3.4292	3.4292		1.7915	1.7915
H7	2.4777	1.1011	3.4292	3.4292	4.2221	1.7915		1.7915
H8	2.4777	1.1011	3.4292	4.2221	3.4292	1.7915	1.7915

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.055	Si1	C2	H7	110.055
Si1	C2	H8	110.055	C2	Si1	Cl3	110.472
C2	Si1	Cl4	110.472	C2	Si1	Cl5	110.472
Cl3	Si1	Cl4	108.452	Cl3	Si1	Cl5	108.452
Cl4	Si1	Cl5	108.452	H6	C2	H7	108.881
H6	C2	H8	108.881	H7	C2	H8	108.881

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: BLYP/6-31+G**

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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Number	Element	Mulliken
1	Si	0.401
2	C	-0.614
3	Cl	-0.119
4	Cl	-0.119
5	Cl	-0.119
6	H	0.190
7	H	0.190
8	H	0.190

	x	y	z
x	11.093	0.000	0.000
y	0.000	11.093	-0.000
z	0.000	-0.000	10.131

<r²>	293.337
(<r²>)^1/2	17.127

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: BLYP/6-31+G**

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)