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	hartrees
Energy at 0K	-1710.246968
Energy at 298.15K
HF Energy	-1710.246968
Nuclear repulsion energy	440.794368

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.854
C2	0.000	0.000	-0.052
H3	0.000	-1.407	2.292
H4	1.219	0.704	2.292
H5	-1.219	0.704	2.292
Cl6	0.000	1.673	-0.638
Cl7	1.449	-0.836	-0.638
Cl8	-1.449	-0.836	-0.638

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9065	1.4739	1.4739	1.4739	3.0010	3.0010	3.0010
C2	1.9065		2.7345	2.7345	2.7345	1.7720	1.7720	1.7720
H3	1.4739	2.7345		2.4375	2.4375	4.2508	3.3177	3.3177
H4	1.4739	2.7345	2.4375		2.4375	3.3177	3.3177	4.2508
H5	1.4739	2.7345	2.4375	2.4375		3.3177	4.2508	3.3177
Cl6	3.0010	1.7720	4.2508	3.3177	3.3177		2.8971	2.8971
Cl7	3.0010	1.7720	3.3177	3.3177	4.2508	2.8971		2.8971
Cl8	3.0010	1.7720	3.3177	4.2508	3.3177	2.8971	2.8971

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	109.281	Si1	C2	Cl7	109.281
Si1	C2	Cl8	109.281	C2	Si1	H3	107.290
C2	Si1	H4	107.290	C2	Si1	H5	107.290
H3	Si1	H4	111.562	H3	Si1	H5	111.562
H4	Si1	H5	111.562	Cl6	C2	Cl7	109.661
Cl6	C2	Cl8	109.661	Cl7	C2	Cl8	109.661

Number	Element	Mulliken
1	Si	0.810
2	C	0.518
3	H	-0.190
4	H	-0.190
5	H	-0.190
6	Cl	-0.252
7	Cl	-0.252
8	Cl	-0.252

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

using model chemistry: B1B95/aug-cc-pV(T+d)Z

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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<r²>	269.142
(<r²>)^1/2	16.406

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

using model chemistry: B1B95/aug-cc-pV(T+d)Z

States and conformations

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