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	hartrees
Energy at 0K	-280.900193
Energy at 298.15K
HF Energy	-280.900193
Nuclear repulsion energy	127.011725

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'	3741	3741	94.09	49.90	0.17	0.29
2	A'	1782	1782	422.39	2.71	0.75	0.86
3	A'	1368	1368	297.80	16.65	0.16	0.28
4	A'	1328	1328	58.96	3.42	0.74	0.85
5	A'	922	922	184.15	11.44	0.08	0.15
6	A'	668	668	10.59	6.43	0.37	0.54
7	A'	595	595	8.48	2.01	0.55	0.71
8	A"	799	799	9.42	0.03	0.75	0.86
9	A"	500	500	114.36	0.76	0.75	0.86

Atom	x (Å)	y (Å)
N1	0.000	0.152
O2	-0.271	-1.221
O3	1.166	0.453
O4	-0.972	0.837
H5	0.615	-1.617

	N1	O2	O3	O4	H5
N1		1.3988	1.2039	1.1894	1.8727
O2	1.3988		2.2054	2.1742	0.9700
O3	1.2039	2.2054		2.1717	2.1423
O4	1.1894	2.1742	2.1717		2.9226
H5	1.8727	0.9700	2.1423	2.9226

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H5	102.978		O2	N1	O3	115.647
O2	N1	O4	114.049		O3	N1	O4	130.303

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

using model chemistry: B3PW91/daug-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	2.136
2	O	-0.687
3	O	-0.835
4	O	-0.966
5	H	0.351

	x	y	z	Total
	1.051	-2.042	0.000	2.297
CHELPG
AIM
ESP

	x	y	z
x	4.625	-0.241	0.000
y	-0.241	4.400	0.000
z	0.000	0.000	2.449

<r²>	54.995
(<r²>)^1/2	7.416

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

using model chemistry: B3PW91/daug-cc-pVTZ

States and conformations

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