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	hartrees
Energy at 0K	-750.220763
Energy at 298.15K
HF Energy	-750.220763
Nuclear repulsion energy	67.989769

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	2013	1942	304.67	243.26	0.43	0.60
2	A'	812	783	52.72	33.30	0.73	0.85
3	A'	509	491	110.19	19.25	0.45	0.62

Atom	x (Å)	y (Å)
Si1	0.048	1.114
Cl2	0.048	-0.990
H3	-1.482	1.238

	Si1	Cl2	H3
Si1		2.1048	1.5352
Cl2	2.1048		2.7030
H3	1.5352	2.7030

Number	Element	Mulliken
1	Si	0.344
2	Cl	-0.241
3	H	-0.103

All results from a given calculation for HSiCl (Chlorosilylene)

using model chemistry: B3PW91/TZVP

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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	-0.256	1.308	0.000	1.333
CHELPG
AIM
ESP

	x	y	z
x	5.309	-0.336	0.000
y	-0.336	7.248	0.000
z	0.000	0.000	3.872

<r²>	54.384
(<r²>)^1/2	7.375