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	hartrees
Energy at 0K	-1709.312611
Energy at 298.15K	-1709.316030
HF Energy	-1709.085264
Nuclear repulsion energy	435.605641

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2313	2199	53.51
2	A₁	948	902	244.29
3	A₁	887	843	33.29
4	A₁	429	408	7.82
5	A₁	287	273	9.95
6	A₂	195	186	0.00
7	E	2334	2219	91.22
7	E	2334	2219	91.20
8	E	970	923	62.14
8	E	970	923	62.16
9	E	762	724	46.66
9	E	761	724	46.63
10	E	619	589	74.49
10	E	619	589	74.48
11	E	277	263	0.01
11	E	277	263	0.01
12	E	166	158	0.05
12	E	166	158	0.05

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.879
C2	0.000	0.000	-0.047
H3	0.000	-1.407	2.315
H4	1.219	0.704	2.315
H5	-1.219	0.704	2.315
Cl6	0.000	1.693	-0.647
Cl7	1.466	-0.846	-0.647
Cl8	-1.466	-0.846	-0.647

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9262	1.4730	1.4730	1.4730	3.0406	3.0406	3.0406
C2	1.9262		2.7490	2.7490	2.7490	1.7958	1.7958	1.7958
H3	1.4730	2.7490		2.4373	2.4373	4.2869	3.3514	3.3514
H4	1.4730	2.7490	2.4373		2.4373	3.3514	3.3514	4.2869
H5	1.4730	2.7490	2.4373	2.4373		3.3514	4.2869	3.3514
Cl6	3.0406	1.7958	4.2869	3.3514	3.3514		2.9318	2.9318
Cl7	3.0406	1.7958	3.3514	3.3514	4.2869	2.9318		2.9318
Cl8	3.0406	1.7958	3.3514	4.2869	3.3514	2.9318	2.9318

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C2	Cl6	109.508	Si1	C2	Cl7	109.508
Si1	C2	Cl8	109.508	C2	Si1	H3	107.189
C2	Si1	H4	107.189	C2	Si1	H5	107.189
H3	Si1	H4	111.654	H3	Si1	H5	111.654
H4	Si1	H5	111.654	Cl6	C2	Cl7	109.435
Cl6	C2	Cl8	109.435	Cl7	C2	Cl8	109.435

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

using model chemistry: B2PLYP=FULL/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: B2PLYP=FULL/6-31+G**

States and conformations

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