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	hartrees
Energy at 0K	-205.019870
Energy at 298.15K	-205.020924
HF Energy	-205.019870
Nuclear repulsion energy	65.334697

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	1450	1450	0.49	21.53	0.18	0.31
2	A₁	771	771	6.39	0.98	0.74	0.85
3	B₂	1787	1787	381.47	5.12	0.75	0.86

Atom	y (Å)	z (Å)
N1	0.000	0.321
O2	1.095	-0.140
O3	-1.095	-0.140

	N1	O2	O3
N1		1.1883	1.1883
O2	1.1883		2.1907
O3	1.1883	2.1907

Number	Element	Mulliken
1	N	0.470
2	O	-0.235
3	O	-0.235

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

using model chemistry: wB97X-D/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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<r²>	30.003
(<r²>)^1/2	5.478

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

using model chemistry: wB97X-D/6-31G(2df,p)

States and conformations

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