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	hartrees
Energy at 0K	-410.369559
Energy at 298.15K
HF Energy	-410.369559
Nuclear repulsion energy	235.636703

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	1440	1440	0.00	18.17	0.44	0.61
2	A_g	843	843	0.00	16.22	0.10	0.18
3	A_g	280	280	0.00	35.71	0.30	0.46
4	A_u	89	89	0.00	0.00	0.00	0.00
5	B_1u	1291	1291	486.04	0.00	0.00	0.00
6	B_1u	748	748	279.82	0.00	0.00	0.00
7	B_2g	678	678	0.00	0.46	0.75	0.86
8	B_2u	1809	1809	676.59	0.00	0.00	0.00
9	B_2u	203	203	0.07	0.00	0.00	0.00
10	B_3g	1778	1778	0.00	12.63	0.75	0.86
11	B_3g	482	482	0.00	9.84	0.75	0.86
12	B_3u	425	425	13.00	0.00	0.00	0.00

Atom	y (Å)	z (Å)
N1	0.000	0.912
N2	0.000	-0.912
O3	1.097	1.369
O4	-1.097	1.369
O5	1.097	-1.369
O6	-1.097	-1.369

	N1	N2	O3	O4	O5	O6
N1		1.8244	1.1888	1.1888	2.5316	2.5316
N2	1.8244		2.5316	2.5316	1.1888	1.1888
O3	1.1888	2.5316		2.1949	2.7384	3.5095
O4	1.1888	2.5316	2.1949		3.5095	2.7384
O5	2.5316	1.1888	2.7384	3.5095		2.1949
O6	2.5316	1.1888	3.5095	2.7384	2.1949

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O5	112.608	N1	N2	O6	112.608
N2	N1	O3	112.608	N2	N1	O4	112.608
O3	N1	O4	134.783	O5	N2	O6	134.783

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

using model chemistry: TPSSh/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	0.380
2	N	0.380
3	O	-0.190
4	O	-0.190
5	O	-0.190
6	O	-0.190

<r²>	130.725
(<r²>)^1/2	11.434

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

using model chemistry: TPSSh/Def2TZVPP

States and conformations

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