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	hartrees
Energy at 0K	-410.009651
Energy at 298.15K
HF Energy	-410.009651
Nuclear repulsion energy	232.469656

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	1427	1427	0.00	15.62	0.24	0.38
2	A_g	822	822	0.00	10.33	0.09	0.17
3	A_g	255	255	0.00	26.90	0.29	0.45
4	A_u	88	88	0.00	0.00	0.00	0.00
5	B_1u	1279	1279	434.05	0.00	0.00	0.00
6	B_1u	732	732	245.43	0.00	0.00	0.00
7	B_2g	635	635	0.00	0.03	0.75	0.86
8	B_2u	1804	1804	521.14	0.00	0.00	0.00
9	B_2u	184	184	0.14	0.00	0.00	0.00
10	B_3g	1780	1780	0.00	10.35	0.75	0.86
11	B_3g	448	448	0.00	8.52	0.75	0.86
12	B_3u	394	394	10.15	0.00	0.00	0.00

Atom	y (Å)	z (Å)
N1	0.000	0.942
N2	0.000	-0.942
O3	1.104	1.401
O4	-1.104	1.401
O5	1.104	-1.401
O6	-1.104	-1.401

	N1	N2	O3	O4	O5	O6
N1		1.8843	1.1958	1.1958	2.5904	2.5904
N2	1.8843		2.5904	2.5904	1.1958	1.1958
O3	1.1958	2.5904		2.2084	2.8024	3.5680
O4	1.1958	2.5904	2.2084		3.5680	2.8024
O5	2.5904	1.1958	2.8024	3.5680		2.2084
O6	2.5904	1.1958	3.5680	2.8024	2.2084

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	N2	O5	112.574	N1	N2	O6	112.574
N2	N1	O3	112.574	N2	N1	O4	112.574
O3	N1	O4	134.853	O5	N2	O6	134.853

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

using model chemistry: B97D3/6-31G(2df,p)

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	0.546
2	N	0.546
3	O	-0.273
4	O	-0.273
5	O	-0.273
6	O	-0.273

<r²>	134.188
(<r²>)^1/2	11.584

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

using model chemistry: B97D3/6-31G(2df,p)

States and conformations

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