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	hartrees
Energy at 0K	-409.945868
Energy at 298.15K
HF Energy	-409.945868
Nuclear repulsion energy	240.255578

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	1489	1489	0.00	26.40	0.65	0.79
2	A_g	866	866	0.00	27.67	0.13	0.24
3	A_g	319	319	0.00	40.16	0.29	0.45
4	A_u	90	90	0.00	0.00	0.00	0.00
5	B_1u	1357	1357	452.06	0.00	0.00	0.00
6	B_1u	782	782	253.84	0.00	0.00	0.00
7	B_2g	747	747	0.00	0.22	0.75	0.86
8	B_2u	1903	1903	756.99	0.00	0.00	0.00
9	B_2u	245	245	0.03	0.00	0.00	0.00
10	B_3g	1861	1861	0.00	10.70	0.75	0.86
11	B_3g	520	520	0.00	7.76	0.75	0.86
12	B_3u	472	472	17.27	0.00	0.00	0.00

Atom	y (Å)	z (Å)
N1	0.000	0.874
N2	0.000	-0.874
O3	1.088	1.325
O4	-1.088	1.325
O5	1.088	-1.325
O6	-1.088	-1.325

	N1	N2	O3	O4	O5	O6
N1		1.7480	1.1775	1.1775	2.4536	2.4536
N2	1.7480		2.4536	2.4536	1.1775	1.1775
O3	1.1775	2.4536		2.1753	2.6506	3.4289
O4	1.1775	2.4536	2.1753		3.4289	2.6506
O5	2.4536	1.1775	2.6506	3.4289		2.1753
O6	2.4536	1.1775	3.4289	2.6506	2.1753

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O5	112.535	N1	N2	O6	112.535
N2	N1	O3	112.535	N2	N1	O4	112.535
O3	N1	O4	134.931	O5	N2	O6	134.931

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

using model chemistry: HSEh1PBE/6-311+G(3df,2p)

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	0.777
2	N	0.777
3	O	-0.389
4	O	-0.389
5	O	-0.389
6	O	-0.389

<r²>	125.489
(<r²>)^1/2	11.202

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

using model chemistry: HSEh1PBE/6-311+G(3df,2p)

States and conformations

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