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	hartrees
Energy at 0K	-303.004740
Energy at 298.15K	-303.006108
HF Energy	-303.004740
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1449	1424	143.52
2	A'	993	976	12.51
3	A'	707	695	26.11
4	A'	506	497	39.94
5	A'	184	181	0.03
6	A"	334	328	0.23

Atom	x (Å)	y (Å)
F1	1.348	0.402
O2	0.000	1.015
N3	-1.084	-0.201
O4	-0.567	-1.291

	F1	O2	N3	O4
F1		1.4806	2.5054	2.5553
O2	1.4806		1.6293	2.3744
N3	2.5054	1.6293		1.2061
O4	2.5553	2.3744	1.2061

Number	Element	Mulliken
1	F	-0.083
2	O	-0.037
3	N	0.310
4	O	-0.190

All results from a given calculation for FONO (Nitrosyl hypofluorite)

using model chemistry: B97D3/3-21G

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
	-0.680	-0.337	0.000	0.759
CHELPG
AIM
ESP

	x	y	z
x	3.153	0.702	0.000
y	0.702	3.218	0.000
z	0.000	0.000	0.665

<r²>	62.996
(<r²>)^1/2	7.937