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	hartrees
Energy at 0K	-1707.641997
Energy at 298.15K	-1707.645554
HF Energy	-1706.948852
Nuclear repulsion energy	436.850357

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2326	2199	54.32
2	A₁	962	910	247.23
3	A₁	905	855	40.45
4	A₁	442	417	6.90
5	A₁	294	278	9.62
6	A₂	205	194	0.00
7	E	2346	2217	92.76
7	E	2346	2217	92.76
8	E	978	925	66.75
8	E	978	925	66.75
9	E	808	764	39.38
9	E	808	764	39.38
10	E	637	602	58.08
10	E	637	602	58.08
11	E	284	269	0.01
11	E	284	269	0.01
12	E	173	164	0.07
12	E	173	164	0.07

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.879
C2	0.000	0.000	-0.048
H3	0.000	-1.405	2.313
H4	1.217	0.702	2.313
H5	-1.217	0.702	2.313
Cl6	0.000	1.686	-0.646
Cl7	1.460	-0.843	-0.646
Cl8	-1.460	-0.843	-0.646

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9270	1.4706	1.4706	1.4706	3.0358	3.0358	3.0358
C2	1.9270		2.7480	2.7480	2.7480	1.7886	1.7886	1.7886
H3	1.4706	2.7480		2.4333	2.4333	4.2791	3.3475	3.3475
H4	1.4706	2.7480	2.4333		2.4333	3.3475	3.3475	4.2791
H5	1.4706	2.7480	2.4333	2.4333		3.3475	4.2791	3.3475
Cl6	3.0358	1.7886	4.2791	3.3475	3.3475		2.9199	2.9199
Cl7	3.0358	1.7886	3.3475	3.3475	4.2791	2.9199		2.9199
Cl8	3.0358	1.7886	3.3475	4.2791	3.3475	2.9199	2.9199

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	107.196
C2	Si1	H4	107.196	C2	Si1	H5	107.196
H3	Si1	H4	111.647	H3	Si1	H5	111.647
H4	Si1	H5	111.647	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: QCISD/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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All results from a given calculation for SiH3CCl3 ((trichloromethyl)silane)

using model chemistry: QCISD/6-31+G**

States and conformations

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