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	hartrees
Energy at 0K	-1709.942571
Energy at 298.15K	-1709.945989
HF Energy	-1709.942571
Nuclear repulsion energy	437.617579

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2279	2279	40.05
2	A₁	934	934	202.41
3	A₁	891	891	74.82
4	A₁	443	443	9.25
5	A₁	285	285	8.66
6	A₂	164	164	0.01
7	E	2298	2298	64.95
7	E	2298	2298	65.82
8	E	957	957	60.58
8	E	957	957	60.62
9	E	796	796	62.87
9	E	795	795	63.60
10	E	614	614	61.64
10	E	614	614	62.34
11	E	280	280	0.00
11	E	280	280	0.00
12	E	165	165	0.00
12	E	165	165	0.01

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.874
C2	0.000	0.000	-0.047
H3	0.000	-1.412	2.295
H4	1.223	0.706	2.295
H5	-1.223	0.706	2.295
Cl6	0.000	1.683	-0.644
Cl7	1.458	-0.842	-0.644
Cl8	-1.458	-0.842	-0.644

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9215	1.4738	1.4738	1.4738	3.0291	3.0291	3.0291
C2	1.9215		2.7352	2.7352	2.7352	1.7861	1.7861	1.7861
H3	1.4738	2.7352		2.4464	2.4464	4.2688	3.3301	3.3301
H4	1.4738	2.7352	2.4464		2.4464	3.3301	3.3301	4.2688
H5	1.4738	2.7352	2.4464	2.4464		3.3301	4.2688	3.3301
Cl6	3.0291	1.7861	4.2688	3.3301	3.3301		2.9158	2.9158
Cl7	3.0291	1.7861	3.3301	3.3301	4.2688	2.9158		2.9158
Cl8	3.0291	1.7861	3.3301	4.2688	3.3301	2.9158	2.9158

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	109.520	Si1	C2	Cl7	109.520
Si1	C2	Cl8	109.520	C2	Si1	H3	106.594
C2	Si1	H4	106.594	C2	Si1	H5	106.594
H3	Si1	H4	112.189	H3	Si1	H5	112.189
H4	Si1	H5	112.189	Cl6	C2	Cl7	109.423
Cl6	C2	Cl8	109.423	Cl7	C2	Cl8	109.423

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

using model chemistry: M06-2X/6-311G**

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	0.738
2	C	-0.625
3	H	-0.085
4	H	-0.085
5	H	-0.085
6	Cl	0.048
7	Cl	0.048
8	Cl	0.048

	x	y	z
x	10.366	0.000	0.000
y	0.000	10.365	0.002
z	0.000	0.002	9.029

<r²>	273.374
(<r²>)^1/2	16.534

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

using model chemistry: M06-2X/6-311G**

States and conformations

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