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	hartrees
Energy at 0K	-54.886741
Energy at 298.15K	-54.890234
HF Energy	-54.886741
Nuclear repulsion energy	84.750786

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2311	2109	42.12
2	A₁	946	863	334.33
3	A₁	893	814	5.33
4	A₁	422	385	12.82
5	A₁	289	264	15.32
6	A₂	158	144	0.00
7	E	2340	2135	90.53
7	E	2340	2135	90.53
8	E	966	882	79.95
8	E	966	882	79.95
9	E	790	721	46.63
9	E	790	721	46.63
10	E	636	580	84.84
10	E	636	580	84.84
11	E	283	259	0.45
11	E	283	259	0.45
12	E	180	164	0.00
12	E	180	164	0.00

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.933
C2	0.000	0.000	-0.027
H3	0.000	-1.424	2.358
H4	1.234	0.712	2.358
H5	-1.234	0.712	2.358
Cl6	0.000	1.734	-0.666
Cl7	1.501	-0.867	-0.666
Cl8	-1.501	-0.867	-0.666

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9596	1.4863	1.4863	1.4863	3.1241	3.1241	3.1241
C2	1.9596		2.7774	2.7774	2.7774	1.8478	1.8478	1.8478
H3	1.4863	2.7774		2.4670	2.4670	4.3722	3.4217	3.4217
H4	1.4863	2.7774	2.4670		2.4670	3.4217	3.4217	4.3722
H5	1.4863	2.7774	2.4670	2.4670		3.4217	4.3722	3.4217
Cl6	3.1241	1.8478	4.3722	3.4217	3.4217		3.0027	3.0027
Cl7	3.1241	1.8478	3.4217	3.4217	4.3722	3.0027		3.0027
Cl8	3.1241	1.8478	3.4217	4.3722	3.4217	3.0027	3.0027

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	110.246	Si1	C2	Cl7	110.246
Si1	C2	Cl8	110.246	C2	Si1	H3	106.609
C2	Si1	H4	106.609	C2	Si1	H5	106.609
H3	Si1	H4	112.176	H3	Si1	H5	112.176
H4	Si1	H5	112.176	Cl6	C2	Cl7	108.686
Cl6	C2	Cl8	108.686	Cl7	C2	Cl8	108.686

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

using model chemistry: HF/CEP-121G

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	0.782
2	C	-0.723
3	H	-0.098
4	H	-0.098
5	H	-0.098
6	Cl	0.079
7	Cl	0.079
8	Cl	0.079

<r²>	145.779
(<r²>)^1/2	12.074

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

using model chemistry: HF/CEP-121G

States and conformations

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