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	hartrees
Energy at 0K	-410.031020
Energy at 298.15K
HF Energy	-410.031020
Nuclear repulsion energy	239.817860

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	1495	1418	0.00	18.58	0.51	0.67
2	A_g	857	813	0.00	15.37	0.13	0.23
3	A_g	341	323	0.00	32.96	0.32	0.48
4	A_u	94	89	0.00	0.00	0.00	0.00
5	B_1u	1382	1310	430.42	0.00	0.00	0.00
6	B_1u	782	741	218.79	0.00	0.00	0.00
7	B_2g	729	691	0.00	0.53	0.75	0.86
8	B_2u	1921	1823	638.81	0.00	0.00	0.00
9	B_2u	270	256	0.27	0.00	0.00	0.00
10	B_3g	1892	1795	0.00	4.84	0.75	0.86
11	B_3g	543	515	0.00	8.94	0.75	0.86
12	B_3u	470	446	21.19	0.00	0.00	0.00

Atom	y (Å)	z (Å)
N1	0.000	0.857
N2	0.000	-0.857
O3	1.097	1.317
O4	-1.097	1.317
O5	1.097	-1.317
O6	-1.097	-1.317

	N1	N2	O3	O4	O5	O6
N1		1.7138	1.1895	1.1895	2.4349	2.4349
N2	1.7138		2.4349	2.4349	1.1895	1.1895
O3	1.1895	2.4349		2.1938	2.6339	3.4279
O4	1.1895	2.4349	2.1938		3.4279	2.6339
O5	2.4349	1.1895	2.6339	3.4279		2.1938
O6	2.4349	1.1895	3.4279	2.6339	2.1938

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O5	112.754	N1	N2	O6	112.754
N2	N1	O3	112.754	N2	N1	O4	112.754
O3	N1	O4	134.491	O5	N2	O6	134.491

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

using model chemistry: wB97X-D/6-31G*

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	0.618
2	N	0.618
3	O	-0.309
4	O	-0.309
5	O	-0.309
6	O	-0.309

<r²>	124.764
(<r²>)^1/2	11.170

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

using model chemistry: wB97X-D/6-31G*

States and conformations

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