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	hartrees
Energy at 0K	-110.094133
Energy at 298.15K	-110.096836
HF Energy	-110.094133
Nuclear repulsion energy	32.341398

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3113	3077	0.00
2	A_g	1651	1632	0.00
3	A_g	1523	1506	0.00
4	A_u	1314	1299	98.70
5	B_u	3138	3102	44.30
6	B_u	1299	1284	66.40

Atom	x (Å)	y (Å)
N1	0.000	0.617
N2	0.000	-0.617
H3	1.001	0.920
H4	-1.001	-0.920

	N1	N2	H3	H4
N1		1.2332	1.0463	1.8340
N2	1.2332		1.8340	1.0463
H3	1.0463	1.8340		2.7195
H4	1.8340	1.0463	2.7195

Number	Element	Mulliken
1	N	-0.220
2	N	-0.220
3	H	0.220
4	H	0.220

All results from a given calculation for N₂H₂ ((E)-diazene)

using model chemistry: SVWN/TZVP

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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You are here: Calculated > Energy > Optimized > Energy

	x	y	z
x	2.542	0.673	0.000
y	0.673	3.105	0.000
z	0.000	0.000	1.366

<r²>	16.569
(<r²>)^1/2	4.070

All results from a given calculation for N2H2 ((E)-diazene)

using model chemistry: SVWN/TZVP

States and conformations

All results from a given calculation for N₂H₂ ((E)-diazene)