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	hartrees
Energy at 0K	-185.583850
Energy at 298.15K	-185.583100
HF Energy	-185.583850
Nuclear repulsion energy	76.583848

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2531	2397	0.00
2	Σ_g	897	850	0.00
3	Σ_u	2345	2221	0.01
4	Π_g	571	541	0.00
4	Π_g	571	541	0.00
5	Π_u	252	239	18.55
5	Π_u	252	239	18.55

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.696
C2	0.000	0.000	-0.696
N3	0.000	0.000	1.852
N4	0.000	0.000	-1.852

	C1	C2	N3	N4
C1		1.3917	1.1561	2.5478
C2	1.3917		2.5478	1.1561
N3	1.1561	2.5478		3.7039
N4	2.5478	1.1561	3.7039

Number	Element	Mulliken
1	C	0.403
2	C	0.403
3	N	-0.403
4	N	-0.403

All results from a given calculation for C₂N₂ (Cyanogen)

using model chemistry: M06-2X/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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<r²>	68.524
(<r²>)^1/2	8.278

All results from a given calculation for C2N2 (Cyanogen)

using model chemistry: M06-2X/6-31G*

States and conformations

All results from a given calculation for C₂N₂ (Cyanogen)