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	hartrees
Energy at 0K	-1710.049383
Energy at 298.15K	-1710.052376
HF Energy	-1710.049383
Nuclear repulsion energy	416.907170

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3065	2946	0.29
2	A₁	1390	1336	21.78
3	A₁	753	724	51.83
4	A₁	378	363	24.27
5	A₁	200	192	19.61
6	A₂	203	196	0.00
7	E	3171	3048	1.12
7	E	3171	3048	1.12
8	E	1470	1413	10.29
8	E	1470	1413	10.29
9	E	924	888	83.49
9	E	924	888	83.48
10	E	507	487	118.18
10	E	507	487	118.16
11	E	200	192	4.39
11	E	200	192	4.39
12	E	135	130	1.41
12	E	135	130	1.41

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.280
C2	0.000	0.000	2.150
Cl3	0.000	2.035	-0.479
Cl4	1.762	-1.018	-0.479
Cl5	-1.762	-1.018	-0.479
H6	0.000	-1.027	2.531
H7	0.890	0.514	2.531
H8	-0.890	0.514	2.531

	Si1	C2	Cl3	Cl4	Cl5	H6	H7	H8
Si1		1.8701	2.1721	2.1721	2.1721	2.4742	2.4742	2.4742
C2	1.8701		3.3249	3.3249	3.3249	1.0955	1.0955	1.0955
Cl3	2.1721	3.3249		3.5249	3.5249	4.2940	3.4881	3.4881
Cl4	2.1721	3.3249	3.5249		3.5249	3.4881	3.4881	4.2940
Cl5	2.1721	3.3249	3.5249	3.5249		3.4881	4.2940	3.4881
H6	2.4742	1.0955	4.2940	3.4881	3.4881		1.7791	1.7791
H7	2.4742	1.0955	3.4881	3.4881	4.2940	1.7791		1.7791
H8	2.4742	1.0955	3.4881	4.2940	3.4881	1.7791	1.7791

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	H6	110.343	Si1	C2	H7	110.343
Si1	C2	H8	110.343	C2	Si1	Cl3	110.457
C2	Si1	Cl4	110.457	C2	Si1	Cl5	110.457
Cl3	Si1	Cl4	108.468	Cl3	Si1	Cl5	108.468
Cl4	Si1	Cl5	108.468	H6	C2	H7	108.586
H6	C2	H8	108.586	H7	C2	H8	108.586

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)

using model chemistry: B3LYP/SDD

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	0.987
2	C	-0.962
3	Cl	-0.274
4	Cl	-0.274
5	Cl	-0.274
6	H	0.266
7	H	0.266
8	H	0.266

<r²>	311.813
(<r²>)^1/2	17.658

All results from a given calculation for SiCl3CH3 (methyltrichlorosilane)

using model chemistry: B3LYP/SDD

States and conformations

All results from a given calculation for SiCl₃CH₃ (methyltrichlorosilane)