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	hartrees
Energy at 0K	-227.331501
Energy at 298.15K	-227.332396
Nuclear repulsion energy	63.716259

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1540	1512	109.05
2	A'	887	871	117.50
3	A'	550	541	10.04

Atom	x (Å)	y (Å)
F1	-0.995	-0.590
N2	0.000	0.568
O3	1.119	0.167

	F1	N2	O3
F1		1.5271	2.2459
N2	1.5271		1.1892
O3	2.2459	1.1892

Number	Element	Mulliken
1	F	-0.158
2	N	0.330
3	O	-0.172

All results from a given calculation for FNO (Nitrosyl fluoride)

using model chemistry: LSDA/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
	0.532	0.392	0.000	0.661
CHELPG
AIM
ESP

	x	y	z
x	2.486	0.535	0.000
y	0.535	1.218	0.000
z	0.000	0.000	0.611

<r²>	0.000
(<r²>)^1/2	0.000