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	hartrees
Energy at 0K	-751.279139
Energy at 298.15K
HF Energy	-751.279139
Nuclear repulsion energy	86.332257

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	2246	2246	51.36	274.39	0.01	0.02
2	A₁	941	941	240.83	5.35	0.53	0.69
3	A₁	554	554	68.44	8.19	0.24	0.39
4	E	2258	2258	95.54	73.31	0.75	0.86
4	E	2258	2258	95.56	73.30	0.75	0.86
5	E	946	946	54.63	11.65	0.75	0.86
5	E	946	946	54.64	11.65	0.75	0.86
6	E	655	655	23.81	6.20	0.75	0.86
6	E	655	655	23.81	6.20	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	-0.985
Cl2	0.000	0.000	1.068
H3	0.000	1.403	-1.456
H4	1.215	-0.702	-1.456
H5	-1.215	-0.702	-1.456

	Si1	Cl2	H3	H4	H5
Si1		2.0538	1.4803	1.4803	1.4803
Cl2	2.0538		2.8886	2.8886	2.8886
H3	1.4803	2.8886		2.4308	2.4308
H4	1.4803	2.8886	2.4308		2.4308
H5	1.4803	2.8886	2.4308	2.4308

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	Si1	H3	108.548	Cl2	Si1	H4	108.548
Cl2	Si1	H5	108.548	H3	Si1	H4	110.378
H3	Si1	H5	110.378	H4	Si1	H5	110.378

All results from a given calculation for SiH₃Cl (chlorosilane)

using model chemistry: PBE1PBE/Def2TZVPP

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	0.383
2	Cl	-0.247
3	H	-0.045
4	H	-0.045
5	H	-0.045

	x	y	z	Total
	0.000	0.000	-1.261	1.261
CHELPG
AIM
ESP

<r²>	62.410
(<r²>)^1/2	7.900

All results from a given calculation for SiH3Cl (chlorosilane)

using model chemistry: PBE1PBE/Def2TZVPP

States and conformations

All results from a given calculation for SiH₃Cl (chlorosilane)