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	hartrees
Energy at 0K	-1707.319126
Energy at 298.15K	-1707.322597
HF Energy	-1707.319126
Nuclear repulsion energy	438.374676

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3164	2880	0.57
2	A₁	1422	1295	19.80
3	A₁	788	717	75.78
4	A₁	468	426	23.61
5	A₁	247	225	13.62
6	A₂	184	167	0.00
7	E	3244	2952	4.25
7	E	3244	2952	4.25
8	E	1567	1426	2.93
8	E	1567	1426	2.93
9	E	887	807	77.95
9	E	887	807	77.95
10	E	600	546	173.98
10	E	600	546	173.98
11	E	234	213	4.33
11	E	234	213	4.33
12	E	164	150	0.57
12	E	164	150	0.57

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.258
C2	0.000	0.000	2.110
Cl3	0.000	1.916	-0.465
Cl4	1.660	-0.958	-0.465
Cl5	-1.660	-0.958	-0.465
H6	0.000	-1.017	2.482
H7	0.881	0.509	2.482
H8	-0.881	0.509	2.482

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8515	2.0483	2.0483	2.0483	2.4458	2.4458	2.4458
C2	1.8515		3.2096	3.2096	3.2096	1.0833	1.0833	1.0833
Cl3	2.0483	3.2096		3.3192	3.3192	4.1585	3.3831	3.3831
Cl4	2.0483	3.2096	3.3192		3.3192	3.3831	3.3831	4.1585
Cl5	2.0483	3.2096	3.3192	3.3192		3.3831	4.1585	3.3831
H6	2.4458	1.0833	4.1585	3.3831	3.3831		1.7617	1.7617
H7	2.4458	1.0833	3.3831	3.3831	4.1585	1.7617		1.7617
H8	2.4458	1.0833	3.3831	4.1585	3.3831	1.7617	1.7617

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.128	Si1	C2	H7	110.128
Si1	C2	H8	110.128	C2	Si1	Cl3	110.673
C2	Si1	Cl4	110.673	C2	Si1	Cl5	110.673
Cl3	Si1	Cl4	108.243	Cl3	Si1	Cl5	108.243
Cl4	Si1	Cl5	108.243	H6	C2	H7	108.807
H6	C2	H8	108.807	H7	C2	H8	108.807

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: HF/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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Number	Element	Mulliken
1	Si	0.756
2	C	-0.371
3	Cl	-0.247
4	Cl	-0.247
5	Cl	-0.247
6	H	0.119
7	H	0.119
8	H	0.119

<r²>	283.800
(<r²>)^1/2	16.846

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: HF/cc-pVTZ

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)