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	hartrees
Energy at 0K	-110.564825
Energy at 298.15K
HF Energy	-110.564825
Nuclear repulsion energy	32.272033

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	2850	2850	222.98	470.74	0.10	0.19
2	A₁	1701	1701	14.82	24.05	0.18	0.31
3	A₁	1600	1600	50.48	20.50	0.52	0.68
4	B₁	996	996	87.21	6.16	0.75	0.86
5	B₂	2742	2742	282.26	1152.65	0.75	0.86
6	B₂	1287	1287	14.11	16.59	0.75	0.86

Atom	y (Å)	z (Å)
N1	0.000	-0.458
N2	0.000	0.759
H3	0.875	-1.055
H4	-0.875	-1.055

	N1	N2	H3	H4
N1		1.2175	1.0593	1.0593
N2	1.2175		2.0143	2.0143
H3	1.0593	2.0143		1.7504
H4	1.0593	2.0143	1.7504

Number	Element	Mulliken
1	N	0.371
2	N	-0.422
3	H	0.025
4	H	0.025

All results from a given calculation for H₂NN (Isodiazene)

using model chemistry: B97D3/aug-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>	17.011
(<r²>)^1/2	4.124

All results from a given calculation for H2NN (Isodiazene)

using model chemistry: B97D3/aug-cc-pVDZ

States and conformations

All results from a given calculation for H₂NN (Isodiazene)