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	hartrees
Energy at 0K	-1707.186244
Energy at 298.15K	-1707.189690
HF Energy	-1707.186244
Nuclear repulsion energy	438.915245

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3173	2873	0.21
2	A₁	1426	1291	18.46
3	A₁	788	714	75.56
4	A₁	469	425	23.30
5	A₁	248	224	13.32
6	A₂	180	163	0.00
7	E	3260	2952	3.34
7	E	3260	2952	3.34
8	E	1566	1418	2.27
8	E	1566	1418	2.27
9	E	882	799	84.95
9	E	882	799	84.95
10	E	602	545	176.45
10	E	602	545	176.45
11	E	233	211	4.16
11	E	233	211	4.16
12	E	164	149	0.59
12	E	164	149	0.59

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.257
C2	0.000	0.000	2.106
Cl3	0.000	1.914	-0.464
Cl4	1.658	-0.957	-0.464
Cl5	-1.658	-0.957	-0.464
H6	0.000	-1.019	2.480
H7	0.882	0.509	2.480
H8	-0.882	0.509	2.480

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8492	2.0454	2.0454	2.0454	2.4455	2.4455	2.4455
C2	1.8492		3.2047	3.2047	3.2047	1.0852	1.0852	1.0852
Cl3	2.0454	3.2047		3.3152	3.3152	4.1557	3.3794	3.3794
Cl4	2.0454	3.2047	3.3152		3.3152	3.3794	3.3794	4.1557
Cl5	2.0454	3.2047	3.3152	3.3152		3.3794	4.1557	3.3794
H6	2.4455	1.0852	4.1557	3.3794	3.3794		1.7644	1.7644
H7	2.4455	1.0852	3.3794	3.3794	4.1557	1.7644		1.7644
H8	2.4455	1.0852	3.3794	4.1557	3.3794	1.7644	1.7644

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.162	Si1	C2	H7	110.162
Si1	C2	H8	110.162	C2	Si1	Cl3	110.643
C2	Si1	Cl4	110.643	C2	Si1	Cl5	110.643
Cl3	Si1	Cl4	108.274	Cl3	Si1	Cl5	108.274
Cl4	Si1	Cl5	108.274	H6	C2	H7	108.772
H6	C2	H8	108.772	H7	C2	H8	108.772

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: HF/6-31G(2df,p)

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	0.701
2	C	-0.565
3	Cl	-0.220
4	Cl	-0.220
5	Cl	-0.220
6	H	0.175
7	H	0.175
8	H	0.175

<r²>	283.024
(<r²>)^1/2	16.823

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: HF/6-31G(2df,p)

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)