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	hartrees
Energy at 0K	-747.682111
Energy at 298.15K
HF Energy	-747.682111
Nuclear repulsion energy	86.331460

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	2300	2207	57.72	194.26	0.01	0.03
2	A₁	966	928	297.17	17.22	0.73	0.85
3	A₁	565	542	66.19	9.58	0.32	0.48
4	E	2313	2220	113.82	61.65	0.75	0.86
4	E	2313	2220	113.84	61.65	0.75	0.86
5	E	952	913	63.09	22.59	0.75	0.86
5	E	952	913	63.09	22.59	0.75	0.86
6	E	671	644	32.81	12.15	0.75	0.86
6	E	671	644	32.81	12.15	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	-0.984
Cl2	0.000	0.000	1.068
H3	0.000	1.405	-1.461
H4	1.217	-0.703	-1.461
H5	-1.217	-0.703	-1.461

	Si1	Cl2	H3	H4	H5
Si1		2.0522	1.4836	1.4836	1.4836
Cl2	2.0522		2.8929	2.8929	2.8929
H3	1.4836	2.8929		2.4335	2.4335
H4	1.4836	2.8929	2.4335		2.4335
H5	1.4836	2.8929	2.4335	2.4335

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cl2	Si1	H3	108.735	Cl2	Si1	H4	108.735
Cl2	Si1	H5	108.735	H3	Si1	H4	110.197
H3	Si1	H5	110.197	H4	Si1	H5	110.197

All results from a given calculation for SiH₃Cl (chlorosilane)

using model chemistry: PBE1PBE/3-21G*

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	0.435
2	Cl	-0.314
3	H	-0.040
4	H	-0.040
5	H	-0.040

	x	y	z	Total
	0.000	0.000	-1.686	1.686
CHELPG
AIM
ESP

<r²>	62.608
(<r²>)^1/2	7.913

All results from a given calculation for SiH3Cl (chlorosilane)

using model chemistry: PBE1PBE/3-21G*

States and conformations

All results from a given calculation for SiH₃Cl (chlorosilane)