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	hartrees
Energy at 0K	-304.637825
Energy at 298.15K	-304.640021
HF Energy	-304.387174
Nuclear repulsion energy	122.085026

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1358	1289	182.06
2	A₁	842	799	214.49
3	A₁	588	558	39.09
4	B₁	740	703	13.26
5	B₂	1872	1777	360.50
6	B₂	557	529	4.52

Atom	y (Å)	z (Å)
N1	0.000	-0.186
F2	0.000	1.282
O3	1.104	-0.640
O4	-1.104	-0.640

	N1	F2	O3	O4
N1		1.4672	1.1939	1.1939
F2	1.4672		2.2161	2.2161
O3	1.1939	2.2161		2.2083
O4	1.1939	2.2161	2.2083

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
F2	N1	O3	112.364		F2	N1	O4	112.364
O3	N1	O4	135.272

All results from a given calculation for FNO₂ (Nitryl fluoride)

using model chemistry: B2PLYP/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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Number	Element	Mulliken
1	N	0.772
2	F	-0.241
3	O	-0.265
4	O	-0.265

	x	y	z	Total
	0.000	0.000	-0.274	0.274
CHELPG
AIM
ESP

<r²>	54.126
(<r²>)^1/2	7.357

All results from a given calculation for FNO2 (Nitryl fluoride)

using model chemistry: B2PLYP/6-31G*

States and conformations

All results from a given calculation for FNO₂ (Nitryl fluoride)