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	hartrees
Energy at 0K	-205.082702
Energy at 298.15K	-205.083760
HF Energy	-205.082702
Nuclear repulsion energy	65.621683

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	1445	1445	0.12	24.71	0.21	0.35
2	A₁	781	781	5.54	0.44	0.71	0.83
3	B₂	1767	1767	485.83	5.36	0.75	0.86

Atom	y (Å)	z (Å)
N1	0.000	0.318
O2	1.091	-0.139
O3	-1.091	-0.139

	N1	O2	O3
N1		1.1830	1.1830
O2	1.1830		2.1822
O3	1.1830	2.1822

Number	Element	Mulliken
1	N	0.616
2	O	-0.308
3	O	-0.308

All results from a given calculation for NO₂ (Nitrogen dioxide)

using model chemistry: wB97X-D/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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<r²>	30.108
(<r²>)^1/2	5.487

All results from a given calculation for NO2 (Nitrogen dioxide)

using model chemistry: wB97X-D/6-311+G(3df,2p)

States and conformations

All results from a given calculation for NO₂ (Nitrogen dioxide)