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	hartrees
Energy at 0K	-110.046501
Energy at 298.15K	-110.049204
HF Energy	-110.046501
Nuclear repulsion energy	32.113916

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A_g	3097	3038	0.00
2	A_g	1657	1626	0.00
3	A_g	1563	1534	0.00
4	A_u	1311	1286	103.03
5	B_u	3114	3055	78.14
6	B_u	1328	1303	76.30

Atom	x (Å)	y (Å)
N1	0.000	0.622
N2	0.000	-0.622
H3	1.011	0.911
H4	-1.011	-0.911

	N1	N2	H3	H4
N1		1.2443	1.0514	1.8366
N2	1.2443		1.8366	1.0514
H3	1.0514	1.8366		2.7220
H4	1.8366	1.0514	2.7220

Number	Element	Mulliken
1	N	-0.326
2	N	-0.326
3	H	0.326
4	H	0.326

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

using model chemistry: SVWN/6-31G*

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	2.335	0.777	0.000
y	0.777	2.683	0.000
z	0.000	0.000	0.982

<r²>	16.454
(<r²>)^1/2	4.056

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

using model chemistry: SVWN/6-31G*

States and conformations

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