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	hartrees
Energy at 0K	-409.999303
Energy at 298.15K
HF Energy	-409.999303
Nuclear repulsion energy	233.089203

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_g	1409	1392	0.00	16.46	0.35	0.52
2	A_g	822	812	0.00	13.52	0.09	0.17
3	A_g	264	261	0.00	31.96	0.29	0.45
4	A_u	86	85	0.00	0.00	0.00	0.00
5	B_1u	1265	1250	442.18	0.00	0.00	0.00
6	B_1u	730	721	257.30	0.00	0.00	0.00
7	B_2g	638	631	0.00	0.36	0.75	0.86
8	B_2u	1773	1752	591.34	0.00	0.00	0.00
9	B_2u	192	190	0.06	0.00	0.00	0.00
10	B_3g	1745	1724	0.00	15.29	0.75	0.86
11	B_3g	457	451	0.00	9.80	0.75	0.86
12	B_3u	399	394	10.27	0.00	0.00	0.00

Atom	y (Å)	z (Å)
N1	0.000	0.932
N2	0.000	-0.932
O3	1.105	1.392
O4	-1.105	1.392
O5	1.105	-1.392
O6	-1.105	-1.392

	N1	N2	O3	O4	O5	O6
N1		1.8632	1.1967	1.1967	2.5729	2.5729
N2	1.8632		2.5729	2.5729	1.1967	1.1967
O3	1.1967	2.5729		2.2091	2.7842	3.5541
O4	1.1967	2.5729	2.2091		3.5541	2.7842
O5	2.5729	1.1967	2.7842	3.5541		2.2091
O6	2.5729	1.1967	3.5541	2.7842	2.2091

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O5	112.634	N1	N2	O6	112.634
N2	N1	O3	112.634	N2	N1	O4	112.634
O3	N1	O4	134.733	O5	N2	O6	134.733

All results from a given calculation for N₂O₄ (Dinitrogen tetroxide)

using model chemistry: PBEPBE/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	0.311
2	N	0.311
3	O	-0.156
4	O	-0.156
5	O	-0.156
6	O	-0.156

<r²>	133.801
(<r²>)^1/2	11.567

All results from a given calculation for N2O4 (Dinitrogen tetroxide)

using model chemistry: PBEPBE/Def2TZVPP

States and conformations

All results from a given calculation for N₂O₄ (Dinitrogen tetroxide)