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	hartrees
Energy at 0K	-279.302510
Energy at 298.15K
HF Energy	-279.302510
Nuclear repulsion energy	119.992894

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'	3383	3267	29.67	65.08	0.34	0.51
2	A'	1518	1466	94.68	0.92	0.75	0.86
3	A'	1201	1160	151.39	7.84	0.60	0.75
4	A'	1128	1089	177.32	3.26	0.32	0.48
5	A'	829	801	70.21	11.84	0.12	0.22
6	A'	574	554	0.22	7.44	0.52	0.68
7	A'	472	456	12.19	2.69	0.73	0.84
8	A"	653	631	12.49	0.08	0.75	0.86
9	A"	481	464	141.49	7.31	0.75	0.86

Atom	x (Å)	y (Å)
N1	0.000	0.172
O2	-0.310	-1.296
O3	1.244	0.445
O4	-1.013	0.907
H5	0.633	-1.654

	N1	O2	O3	O4	H5
N1		1.5009	1.2735	1.2514	1.9330
O2	1.5009		2.3340	2.3126	1.0087
O3	1.2735	2.3340		2.3036	2.1864
O4	1.2514	2.3126	2.3036		3.0444
H5	1.9330	1.0087	2.1864	3.0444

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H5	98.860		O2	N1	O3	114.299
O2	N1	O4	114.029		O3	N1	O4	131.672

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

using model chemistry: TPSSh/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	0.481
2	O	-0.349
3	O	-0.272
4	O	-0.239
5	H	0.380

	x	y	z	Total
	1.251	-1.728	0.000	2.133
CHELPG
AIM
ESP

	x	y	z
x	3.620	-0.427	0.000
y	-0.427	3.418	0.000
z	0.000	0.000	0.667

<r²>	59.727
(<r²>)^1/2	7.728

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

using model chemistry: TPSSh/3-21G*

States and conformations

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