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	hartrees
Energy at 0K	-1709.816111
Energy at 298.15K	-1709.819498
HF Energy	-1709.816111
Nuclear repulsion energy	437.409439

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2275	2167	46.89
2	A₁	935	890	175.35
3	A₁	892	849	88.84
4	A₁	444	422	8.17
5	A₁	286	272	10.28
6	A₂	165	157	0.00
7	E	2297	2187	78.34
7	E	2297	2187	79.16
8	E	960	914	61.19
8	E	960	914	61.25
9	E	801	763	59.40
9	E	800	762	60.21
10	E	611	582	53.52
10	E	611	581	54.30
11	E	277	264	0.03
11	E	277	264	0.03
12	E	164	156	0.05
12	E	163	155	0.05

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.874
C2	0.000	0.000	-0.050
H3	0.000	-1.413	2.300
H4	1.223	0.706	2.300
H5	-1.223	0.706	2.300
Cl6	0.000	1.685	-0.644
Cl7	1.459	-0.842	-0.644
Cl8	-1.459	-0.842	-0.644

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9242	1.4753	1.4753	1.4753	3.0295	3.0295	3.0295
C2	1.9242		2.7417	2.7417	2.7417	1.7862	1.7862	1.7862
H3	1.4753	2.7417		2.4466	2.4466	4.2729	3.3345	3.3345
H4	1.4753	2.7417	2.4466		2.4466	3.3345	3.3345	4.2729
H5	1.4753	2.7417	2.4466	2.4466		3.3345	4.2729	3.3345
Cl6	3.0295	1.7862	4.2729	3.3345	3.3345		2.9178	2.9178
Cl7	3.0295	1.7862	3.3345	3.3345	4.2729	2.9178		2.9178
Cl8	3.0295	1.7862	3.3345	4.2729	3.3345	2.9178	2.9178

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	109.417	Si1	C2	Cl7	109.417
Si1	C2	Cl8	109.417	C2	Si1	H3	106.771
C2	Si1	H4	106.771	C2	Si1	H5	106.771
H3	Si1	H4	112.032	H3	Si1	H5	112.032
H4	Si1	H5	112.031	Cl6	C2	Cl7	109.525
Cl6	C2	Cl8	109.525	Cl7	C2	Cl8	109.525

All results from a given calculation for SiH₃CCl₃ ((trichloromethyl)silane)

using model chemistry: M06-2X/6-31+G**

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	0.595
2	C	-0.774
3	H	-0.069
4	H	-0.069
5	H	-0.069
6	Cl	0.129
7	Cl	0.129
8	Cl	0.129

	x	y	z
x	11.073	0.000	0.000
y	0.000	11.075	0.001
z	0.000	0.001	10.120

<r²>	273.303
(<r²>)^1/2	16.532

All results from a given calculation for SiH3CCl3 ((trichloromethyl)silane)

using model chemistry: M06-2X/6-31+G**

States and conformations

All results from a given calculation for SiH₃CCl₃ ((trichloromethyl)silane)