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	hartrees
Energy at 0K	-163.989238
Energy at 298.15K	-163.990368
HF Energy	-163.989238
Nuclear repulsion energy	54.226524

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	1329	1321	0.00
2	Σ_u	1774	1764	102.75
3	Π_u	571	567	4.66
3	Π_u	465	463	12.57

Atom	x (Å)	y (Å)	z (Å)
N1	0.000	0.000	0.000
N2	0.000	0.000	1.195
N3	0.000	0.000	-1.195

	N1	N2	N3
N1		1.1954	1.1954
N2	1.1954		2.3909
N3	1.1954	2.3909

Number	Element	Mulliken
1	N	0.258
2	N	-0.129
3	N	-0.129

All results from a given calculation for N₃ (azide radical)

using model chemistry: PBEPBE/cc-pVDZ

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>	30.437
(<r²>)^1/2	5.517

All results from a given calculation for N3 (azide radical)

using model chemistry: PBEPBE/cc-pVDZ

States and conformations

All results from a given calculation for N₃ (azide radical)