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	hartrees
Energy at 0K	-304.786287
Energy at 298.15K	-304.788071
HF Energy	-304.786287
Nuclear repulsion energy	119.875636

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1887	1887	200.29
2	A'	1054	1054	10.05
3	A'	879	879	56.56
4	A'	586	586	172.54
5	A'	347	347	1.09
6	A"	404	404	0.52

Atom	x (Å)	y (Å)
F1	1.280	0.347
O2	0.000	0.900
N3	-0.983	-0.113
O4	-0.580	-1.191

	F1	O2	N3	O4
F1		1.3946	2.3100	2.4146
O2	1.3946		1.4118	2.1703
N3	2.3100	1.4118		1.1509
O4	2.4146	2.1703	1.1509

Number	Element	Mulliken
1	F	-0.126
2	O	-0.033
3	N	0.294
4	O	-0.135

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

using model chemistry: M06-2X/6-311G*

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
	-0.655	-0.106	0.000	0.663
CHELPG
AIM
ESP

	x	y	z
x	3.015	0.409	0.000
y	0.409	3.032	0.000
z	0.000	0.000	1.098

<r²>	56.276
(<r²>)^1/2	7.502