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	hartrees
Energy at 0K	-279.288355
Energy at 298.15K
HF Energy	-279.288355
Nuclear repulsion energy	120.748393

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3397	3278	32.05	63.81	0.34	0.50
2	A'	1535	1481	102.66	1.00	0.75	0.86
3	A'	1220	1178	155.01	7.59	0.60	0.75
4	A'	1144	1104	185.34	3.48	0.29	0.45
5	A'	844	815	75.91	11.54	0.12	0.22
6	A'	590	570	0.21	7.34	0.51	0.68
7	A'	492	475	11.39	2.69	0.73	0.84
8	A"	667	643	15.61	0.10	0.75	0.86
9	A"	482	465	143.20	7.15	0.75	0.86

Atom	x (Å)	y (Å)
N1	0.000	0.170
O2	-0.303	-1.289
O3	1.233	0.450
O4	-1.010	0.897
H5	0.634	-1.655

	N1	O2	O3	O4	H5
N1		1.4897	1.2645	1.2444	1.9320
O2	1.4897		2.3197	2.2973	1.0056
O3	1.2645	2.3197		2.2871	2.1886
O4	1.2444	2.2973	2.2871		3.0357
H5	1.9320	1.0056	2.1886	3.0357

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H5	99.650		O2	N1	O3	114.509
O2	N1	O4	114.039		O3	N1	O4	131.452

All results from a given calculation for HNO₃ (Nitric acid)

using model chemistry: B3LYPultrafine/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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Number	Element	Mulliken
1	N	0.506
2	O	-0.353
3	O	-0.281
4	O	-0.248
5	H	0.376

	x	y	z	Total
	1.258	-1.758	0.000	2.162
CHELPG
AIM
ESP

	x	y	z
x	3.574	-0.436	0.000
y	-0.436	3.325	0.000
z	0.000	0.000	0.663

<r²>	59.173
(<r²>)^1/2	7.692

All results from a given calculation for HNO3 (Nitric acid)

using model chemistry: B3LYPultrafine/3-21G

States and conformations

All results from a given calculation for HNO₃ (Nitric acid)