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	hartrees
Energy at 0K	-1691.299315
Energy at 298.15K	-1691.302257
HF Energy	-1691.299315
Nuclear repulsion energy	427.818209

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3321	2964	9.15
2	A₁	1500	1338	1.38
3	A₁	824	736	49.18
4	A₁	458	409	16.01
5	A₁	222	198	30.53
6	A₂	118	105	0.00
7	E	3492	3116	4.09
7	E	3492	3116	4.09
8	E	1656	1478	3.29
8	E	1656	1478	3.29
9	E	983	878	74.70
9	E	983	878	74.70
10	E	631	563	92.05
10	E	631	563	92.05
11	E	215	192	8.45
11	E	215	192	8.45
12	E	151	135	2.20
12	E	151	135	2.20

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.265
C2	0.000	0.000	2.137
Cl3	0.000	1.971	-0.472
Cl4	1.707	-0.986	-0.472
Cl5	-1.707	-0.986	-0.472
H6	0.000	-1.031	2.516
H7	0.893	0.515	2.516
H8	-0.893	0.515	2.516

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8719	2.1042	2.1042	2.1042	2.4758	2.4758	2.4758
C2	1.8719		3.2695	3.2695	3.2695	1.0983	1.0983	1.0983
Cl3	2.1042	3.2695		3.4140	3.4140	4.2352	3.4412	3.4412
Cl4	2.1042	3.2695	3.4140		3.4140	3.4412	3.4412	4.2352
Cl5	2.1042	3.2695	3.4140	3.4140		3.4412	4.2352	3.4412
H6	2.4758	1.0983	4.2352	3.4412	3.4412		1.7853	1.7853
H7	2.4758	1.0983	3.4412	3.4412	4.2352	1.7853		1.7853
H8	2.4758	1.0983	3.4412	4.2352	3.4412	1.7853	1.7853

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.197	Si1	C2	H7	110.197
Si1	C2	H8	110.197	C2	Si1	Cl3	110.492
C2	Si1	Cl4	110.492	C2	Si1	Cl5	110.492
Cl3	Si1	Cl4	108.431	Cl3	Si1	Cl5	108.431
Cl4	Si1	Cl5	108.431	H6	C2	H7	108.736
H6	C2	H8	108.736	H7	C2	H8	108.736

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: B3LYP/STO-3G

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	0.925
2	C	-0.384
3	Cl	-0.284
4	Cl	-0.284
5	Cl	-0.284
6	H	0.104
7	H	0.104
8	H	0.104

<r²>	295.154
(<r²>)^1/2	17.180

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: B3LYP/STO-3G

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)