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	hartrees
Energy at 0K	-55.068055
Energy at 298.15K	-55.071163
HF Energy	-55.068055
Nuclear repulsion energy	78.792065

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3221	2903	8.47
2	A₁	1482	1336	21.51
3	A₁	759	684	46.30
4	A₁	406	366	29.24
5	A₁	212	191	29.68
6	A₂	161	145	0.00
7	E	3336	3007	2.39
7	E	3336	3007	2.39
8	E	1573	1418	12.56
8	E	1573	1418	12.56
9	E	980	884	92.54
9	E	980	884	92.54
10	E	539	486	152.02
10	E	539	486	152.03
11	E	206	186	9.41
11	E	206	186	9.41
12	E	144	130	1.63
12	E	144	130	1.63

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.297
C2	0.000	0.000	2.181
Cl3	0.000	2.018	-0.488
Cl4	1.747	-1.009	-0.488
Cl5	-1.747	-1.009	-0.488
H6	0.000	-1.022	2.552
H7	0.885	0.511	2.552
H8	-0.885	0.511	2.552

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8841	2.1652	2.1652	2.1652	2.4757	2.4757	2.4757
C2	1.8841		3.3461	3.3461	3.3461	1.0873	1.0873	1.0873
Cl3	2.1652	3.3461		3.4948	3.4948	4.2991	3.5065	3.5065
Cl4	2.1652	3.3461	3.4948		3.4948	3.5065	3.5065	4.2991
Cl5	2.1652	3.3461	3.4948	3.4948		3.5065	4.2991	3.5065
H6	2.4757	1.0873	4.2991	3.5065	3.5065		1.7703	1.7703
H7	2.4757	1.0873	3.5065	3.5065	4.2991	1.7703		1.7703
H8	2.4757	1.0873	3.5065	4.2991	3.5065	1.7703	1.7703

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	109.938	Si1	C2	H7	109.938
Si1	C2	H8	109.938	C2	Si1	Cl3	111.264
C2	Si1	Cl4	111.264	C2	Si1	Cl5	111.264
Cl3	Si1	Cl4	107.620	Cl3	Si1	Cl5	107.620
Cl4	Si1	Cl5	107.620	H6	C2	H7	109.000
H6	C2	H8	109.000	H7	C2	H8	109.000

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: HF/CEP-31G

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	0.666
2	C	-0.538
3	Cl	-0.241
4	Cl	-0.241
5	Cl	-0.241
6	H	0.199
7	H	0.199
8	H	0.199

<r²>	169.864
(<r²>)^1/2	13.033

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: HF/CEP-31G

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)