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	hartrees
Energy at 0K	-1211.301739
Energy at 298.15K
HF Energy	-1211.301739
Nuclear repulsion energy	190.680162

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	2270	2270	61.77	221.66	0.04	0.08
2	A₁	957	957	102.41	6.40	0.73	0.85
3	A₁	512	512	41.50	16.99	0.04	0.08
4	A₁	183	183	2.43	2.42	0.62	0.76
5	A₂	709	709	0.00	4.45	0.75	0.86
6	B₁	2285	2285	77.66	71.65	0.75	0.86
7	B₁	594	594	30.34	1.19	0.75	0.86
8	B₂	874	874	227.24	1.59	0.75	0.86
9	B₂	570	570	138.52	3.26	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.766
H2	-1.224	0.000	1.579
H3	1.224	0.000	1.579
Cl4	0.000	1.687	-0.408
Cl5	0.000	-1.687	-0.408

	Si1	H2	H3	Cl4	Cl5
Si1		1.4692	1.4692	2.0552	2.0552
H2	1.4692		2.4475	2.8794	2.8794
H3	1.4692	2.4475		2.8794	2.8794
Cl4	2.0552	2.8794	2.8794		3.3744
Cl5	2.0552	2.8794	2.8794	3.3744

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H2	Si1	H3	112.802	H2	Si1	Cl4	108.421
H2	Si1	Cl5	108.421	H3	Si1	Cl4	108.421
H3	Si1	Cl5	108.421	Cl4	Si1	Cl5	110.354

All results from a given calculation for SiH₂Cl₂ (dichlorosilane)

using model chemistry: B3LYPultrafine/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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Number	Element	Mulliken
1	Si	1.130
2	H	-0.226
3	H	-0.226
4	Cl	-0.339
5	Cl	-0.339

	x	y	z	Total
	0.000	0.000	1.255	1.255
CHELPG
AIM
ESP

All results from a given calculation for SiH2Cl2 (dichlorosilane)

using model chemistry: B3LYPultrafine/aug-cc-pV(T+d)Z

States and conformations

All results from a given calculation for SiH₂Cl₂ (dichlorosilane)