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	hartrees
Energy at 0K	-281.018581
Energy at 298.15K
HF Energy	-281.018581
Nuclear repulsion energy	126.051621

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'	3696	3696	80.10	48.93	0.23	0.38
2	A'	1751	1751	385.37	2.24	0.71	0.83
3	A'	1335	1335	311.83	11.17	0.21	0.34
4	A'	1306	1306	43.74	5.21	0.63	0.77
5	A'	885	885	189.37	9.90	0.08	0.15
6	A'	632	632	20.16	8.70	0.41	0.58
7	A'	569	569	7.69	2.82	0.61	0.76
8	A"	773	773	8.55	0.07	0.75	0.86
9	A"	491	491	115.38	1.75	0.75	0.86

Atom	x (Å)	y (Å)
N1	0.000	0.158
O2	-0.268	-1.236
O3	1.171	0.462
O4	-0.981	0.839
H5	0.626	-1.620

	N1	O2	O3	O4	H5
N1		1.4195	1.2101	1.1944	1.8846
O2	1.4195		2.2258	2.1939	0.9732
O3	1.2101	2.2258		2.1854	2.1515
O4	1.1944	2.1939	2.1854		2.9373
H5	1.8846	0.9732	2.1515	2.9373

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H5	102.323		O2	N1	O3	115.430
O2	N1	O4	113.862		O3	N1	O4	130.708

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

using model chemistry: TPSSh/Def2TZVPP

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	0.479
2	O	-0.188
3	O	-0.282
4	O	-0.239
5	H	0.231

	x	y	z	Total
	1.084	-1.946	0.000	2.228
CHELPG
AIM
ESP

	x	y	z
x	4.328	-0.278	0.000
y	-0.278	4.023	0.000
z	0.000	0.000	1.890

<r²>	55.598
(<r²>)^1/2	7.456

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

using model chemistry: TPSSh/Def2TZVPP

States and conformations

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