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	hartrees
Energy at 0K	-1705.600459
Energy at 298.15K	-1705.603635
HF Energy	-1705.600459
Nuclear repulsion energy	441.723408

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2177	2153	33.60
2	A₁	897	888	32.34
3	A₁	831	822	152.93
4	A₁	436	431	6.22
5	A₁	275	272	7.75
6	A₂	184	182	0.00
7	E	2207	2183	50.52
7	E	2207	2183	50.54
8	E	881	871	43.49
8	E	881	871	43.50
9	E	731	723	59.66
9	E	731	723	59.66
10	E	577	571	49.18
10	E	577	571	49.17
11	E	261	258	0.02
11	E	261	258	0.02
12	E	146	145	0.06
12	E	146	145	0.06

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.841
C2	0.000	0.000	-0.055
H3	0.000	-1.425	2.280
H4	1.234	0.712	2.280
H5	-1.234	0.712	2.280
Cl6	0.000	1.672	-0.633
Cl7	1.448	-0.836	-0.633
Cl8	-1.448	-0.836	-0.633

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.8958	1.4908	1.4908	1.4908	2.9857	2.9857	2.9857
C2	1.8958		2.7354	2.7354	2.7354	1.7687	1.7687	1.7687
H3	1.4908	2.7354		2.4674	2.4674	4.2512	3.3060	3.3060
H4	1.4908	2.7354	2.4674		2.4674	3.3060	3.3060	4.2512
H5	1.4908	2.7354	2.4674	2.4674		3.3060	4.2512	3.3060
Cl6	2.9857	1.7687	4.2512	3.3060	3.3060		2.8952	2.8952
Cl7	2.9857	1.7687	3.3060	3.3060	4.2512	2.8952		2.8952
Cl8	2.9857	1.7687	3.3060	4.2512	3.3060	2.8952	2.8952

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	109.078	Si1	C2	Cl7	109.078
Si1	C2	Cl8	109.078	C2	Si1	H3	107.140
C2	Si1	H4	107.140	C2	Si1	H5	107.140
H3	Si1	H4	111.698	H3	Si1	H5	111.698
H4	Si1	H5	111.698	Cl6	C2	Cl7	109.861
Cl6	C2	Cl8	109.861	Cl7	C2	Cl8	109.861

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

using model chemistry: LSDA/cc-pVTZ

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	0.051
2	C	-0.198
3	H	0.052
4	H	0.052
5	H	0.052
6	Cl	-0.003
7	Cl	-0.003
8	Cl	-0.003

	x	y	z
x	11.559	0.000	0.000
y	0.000	11.559	-0.000
z	0.000	-0.000	11.086

<r²>	268.103
(<r²>)^1/2	16.374

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

using model chemistry: LSDA/cc-pVTZ

States and conformations

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