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	hartrees
Energy at 0K	-407.848764
Energy at 298.15K
HF Energy	-407.848764
Nuclear repulsion energy	224.196888

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	1163	1156	0.00	10.53	0.18	0.31
2	A_g	739	735	0.00	10.27	0.16	0.27
3	A_g	270	268	0.00	22.78	0.32	0.49
4	A_u	97	96	0.00	0.00	0.00	0.00
5	B_1u	1018	1012	322.69	0.00	0.00	0.00
6	B_1u	649	646	142.57	0.00	0.00	0.00
7	B_2g	545	542	0.00	0.10	0.75	0.86
8	B_2u	1405	1397	196.50	0.00	0.00	0.00
9	B_2u	144	143	0.34	0.00	0.00	0.00
10	B_3g	1395	1387	0.00	8.54	0.75	0.86
11	B_3g	409	407	0.00	9.97	0.75	0.86
12	B_3u	344	342	5.50	0.00	0.00	0.00

Atom	y (Å)	z (Å)
N1	0.000	0.938
N2	0.000	-0.938
O3	1.168	1.416
O4	-1.168	1.416
O5	1.168	-1.416
O6	-1.168	-1.416

	N1	N2	O3	O4	O5	O6
N1		1.8763	1.2622	1.2622	2.6278	2.6278
N2	1.8763		2.6278	2.6278	1.2622	1.2622
O3	1.2622	2.6278		2.3369	2.8312	3.6711
O4	1.2622	2.6278	2.3369		3.6711	2.8312
O5	2.6278	1.2622	2.8312	3.6711		2.3369
O6	2.6278	1.2622	3.6711	2.8312	2.3369

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O5	112.226	N1	N2	O6	112.226
N2	N1	O3	112.226	N2	N1	O4	112.226
O3	N1	O4	135.547	O5	N2	O6	135.547

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

using model chemistry: BLYP/3-21G

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	0.417
2	N	0.417
3	O	-0.208
4	O	-0.208
5	O	-0.208
6	O	-0.208

<r²>	140.289
(<r²>)^1/2	11.844

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

using model chemistry: BLYP/3-21G

States and conformations

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