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	hartrees
Energy at 0K	-387.859344
Energy at 298.15K
HF Energy	-387.859344
Nuclear repulsion energy	48.108525

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2003	1922	404.66
2	A'	948	910	106.39
3	A'	886	850	54.72

Atom	x (Å)	y (Å)
Si1	0.064	-0.595
F2	0.064	1.018
H3	-1.462	-0.830

	Si1	F2	H3
Si1		1.6135	1.5441
F2	1.6135		2.3970
H3	1.5441	2.3970

Number	Element	Mulliken
1	Si	0.454
2	F	-0.296
3	H	-0.158

All results from a given calculation for HSiF (fluorosilylene)

using model chemistry: B3PW91/3-21G*

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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	-0.248	-0.544	0.000	0.598
CHELPG
AIM
ESP

	x	y	z
x	3.737	0.592	0.000
y	0.592	3.114	0.000
z	0.000	0.000	3.230

<r²>	28.920
(<r²>)^1/2	5.378