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	hartrees
Energy at 0K	-280.907684
Energy at 298.15K
HF Energy	-280.907684
Nuclear repulsion energy	127.335960

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'	3772	3610	103.08	43.98	0.25	0.40
2	A'	1808	1731	452.56	1.97	0.65	0.79
3	A'	1389	1329	312.66	11.93	0.21	0.34
4	A'	1335	1278	74.00	4.45	0.75	0.86
5	A'	939	899	200.86	10.29	0.09	0.16
6	A'	678	649	9.96	7.74	0.47	0.64
7	A'	597	571	10.49	3.09	0.63	0.78
8	A"	793	759	10.52	0.11	0.75	0.86
9	A"	486	465	138.64	1.53	0.75	0.86

Atom	x (Å)	y (Å)
N1	0.000	0.151
O2	-0.275	-1.217
O3	1.164	0.446
O4	-0.964	0.841
H5	0.606	-1.619

	N1	O2	O3	O4	H5
N1		1.3954	1.2010	1.1856	1.8708
O2	1.3954		2.1997	2.1698	0.9684
O3	1.2010	2.1997		2.1649	2.1395
O4	1.1856	2.1698	2.1649		2.9180
H5	1.8708	0.9684	2.1395	2.9180

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H5	103.152		O2	N1	O3	115.613
O2	N1	O4	114.176		O3	N1	O4	130.210

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

using model chemistry: B1B95/TZVP

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	0.235
2	O	-0.210
3	O	-0.187
4	O	-0.137
5	H	0.300

	x	y	z	Total
	1.147	-2.137	0.000	2.426
CHELPG
AIM
ESP

	x	y	z
x	4.194	-0.316	0.000
y	-0.316	3.665	0.000
z	0.000	0.000	1.654

<r²>	54.847
(<r²>)^1/2	7.406

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

using model chemistry: B1B95/TZVP

States and conformations

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