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	hartrees
Energy at 0K	-276.988120
Energy at 298.15K
HF Energy	-276.988120
Nuclear repulsion energy	118.111067

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'	3728	3276	11.64	39.71	0.30	0.46
2	A'	1775	1560	33.20	0.74	0.61	0.76
3	A'	1354	1190	60.56	9.28	0.59	0.74
4	A'	1339	1177	96.59	3.07	0.47	0.64
5	A'	951	836	34.73	9.45	0.12	0.22
6	A'	537	472	3.99	3.76	0.64	0.78
7	A'	439	386	6.89	1.92	0.67	0.80
8	A"	571	502	8.63	0.17	0.75	0.86
9	A"	487	428	68.88	6.04	0.75	0.86

Atom	x (Å)	y (Å)
N1	0.000	0.158
O2	-0.317	-1.301
O3	1.271	0.436
O4	-1.036	0.931
H5	0.658	-1.638

	N1	O2	O3	O4	H5
N1		1.4933	1.3010	1.2924	1.9128
O2	1.4933		2.3535	2.3447	1.0320
O3	1.3010	2.3535		2.3596	2.1622
O4	1.2924	2.3447	2.3596		3.0771
H5	1.9128	1.0320	2.1622	3.0771

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N1	O2	H5	96.780		O2	N1	O3	114.584
O2	N1	O4	114.449		O3	N1	O4	130.967

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

using model chemistry: mPW1PW91/STO-3G

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	0.158
2	O	-0.139
3	O	-0.128
4	O	-0.101
5	H	0.210

	x	y	z	Total
	0.954	-1.509	0.000	1.785
CHELPG
AIM
ESP

	x	y	z
x	2.693	-0.445	0.000
y	-0.445	2.451	0.000
z	0.000	0.000	0.364

<r²>	59.690
(<r²>)^1/2	7.726

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

using model chemistry: mPW1PW91/STO-3G

States and conformations

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