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	hartrees
Energy at 0K	-1710.001854
Energy at 298.15K	-1710.005070
HF Energy	-1710.001854
Nuclear repulsion energy	436.377180

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2267	2188	47.39
2	A₁	933	900	202.23
3	A₁	874	843	54.11
4	A₁	422	407	8.53
5	A₁	272	263	9.90
6	A₂	190	183	0.00
7	E	2287	2207	76.75
7	E	2287	2207	76.81
8	E	950	916	52.36
8	E	950	916	52.36
9	E	732	707	49.79
9	E	732	707	49.76
10	E	604	583	75.98
10	E	604	583	75.98
11	E	259	250	0.02
11	E	259	250	0.02
12	E	143	138	0.02
12	E	143	138	0.02

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.870
C2	0.000	0.000	-0.049
H3	0.000	-1.410	2.308
H4	1.221	0.705	2.308
H5	-1.221	0.705	2.308
Cl6	0.000	1.691	-0.643
Cl7	1.464	-0.846	-0.643
Cl8	-1.464	-0.846	-0.643

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9189	1.4769	1.4769	1.4769	3.0290	3.0290	3.0290
C2	1.9189		2.7472	2.7472	2.7472	1.7924	1.7924	1.7924
H3	1.4769	2.7472		2.4426	2.4426	4.2814	3.3430	3.3430
H4	1.4769	2.7472	2.4426		2.4426	3.3430	3.3430	4.2814
H5	1.4769	2.7472	2.4426	2.4426		3.3430	4.2814	3.3430
Cl6	3.0290	1.7924	4.2814	3.3430	3.3430		2.9290	2.9290
Cl7	3.0290	1.7924	3.3430	3.3430	4.2814	2.9290		2.9290
Cl8	3.0290	1.7924	3.3430	4.2814	3.3430	2.9290	2.9290

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	109.357	Si1	C2	Cl7	109.357
Si1	C2	Cl8	109.357	C2	Si1	H3	107.279
C2	Si1	H4	107.279	C2	Si1	H5	107.279
H3	Si1	H4	111.571	H3	Si1	H5	111.571
H4	Si1	H5	111.571	Cl6	C2	Cl7	109.586
Cl6	C2	Cl8	109.586	Cl7	C2	Cl8	109.586

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

using model chemistry: TPSSh/6-31G(2df,p)

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: TPSSh/6-31G(2df,p)

States and conformations

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