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	hartrees
Energy at 0K	-380.157191
Energy at 298.15K	-380.159842
HF Energy	-380.157191
Nuclear repulsion energy	183.064078

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1820	1761	422.66
2	A'	1345	1302	217.28
3	A'	1009	976	43.44
4	A'	816	790	158.97
5	A'	654	632	4.67
6	A'	457	442	30.17
7	A'	294	284	2.24
8	A"	727	703	10.40
9	A"	161	156	0.12

Atom	x (Å)	y (Å)
N1	0.000	0.602
O2	-0.661	-0.679
O3	1.184	0.624
O4	-0.830	1.457
F5	0.272	-1.713

	N1	O2	O3	O4	F5
N1		1.4414	1.1844	1.1914	2.3312
O2	1.4414		2.2585	2.1430	1.3926
O3	1.1844	2.2585		2.1793	2.5087
O4	1.1914	2.1430	2.1793		3.3564
F5	2.3312	1.3926	2.5087	3.3564

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	F5	110.674		O2	N1	O3	118.331
O2	N1	O4	108.596		O3	N1	O4	133.073

All results from a given calculation for FNO₃ (Fluorine nitrate)

using model chemistry: B3LYPultrafine/aug-cc-pVTZ

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	1.032
2	O	-0.055
3	O	-0.383
4	O	-0.416
5	F	-0.178

	x	y	z	Total
	-0.027	0.157	0.000	0.160
CHELPG
AIM
ESP

	x	y	z
x	4.870	-0.462	0.000
y	-0.462	5.839	0.000
z	0.000	0.000	2.569

<r²>	91.807
(<r²>)^1/2	9.582

All results from a given calculation for FNO3 (Fluorine nitrate)

using model chemistry: B3LYPultrafine/aug-cc-pVTZ

States and conformations

All results from a given calculation for FNO₃ (Fluorine nitrate)