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	hartrees
Energy at 0K	-304.721399
Energy at 298.15K	-304.723131
HF Energy	-304.721399
Nuclear repulsion energy	119.212443

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1838	1838	177.88
2	A'	1000	1000	13.87
3	A'	858	858	61.21
4	A'	581	581	109.95
5	A'	310	310	0.21
6	A"	416	416	0.28

Atom	x (Å)	y (Å)
F1	1.295	0.337
O2	0.000	0.897
N3	-0.982	-0.092
O4	-0.599	-1.196

	F1	O2	N3	O4
F1		1.4114	2.3171	2.4365
O2	1.4114		1.3934	2.1766
N3	2.3171	1.3934		1.1683
O4	2.4365	2.1766	1.1683

Number	Element	Mulliken
1	F	-0.132
2	O	-0.012
3	N	0.345
4	O	-0.202

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

using model chemistry: wB97X-D/6-31G**

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
	-0.389	0.142	0.000	0.414
CHELPG
AIM
ESP

	x	y	z
x	3.174	0.497	0.000
y	0.497	3.123	0.000
z	0.000	0.000	1.286

<r²>	56.435
(<r²>)^1/2	7.512