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	hartrees
Energy at 0K	-185.588942
Energy at 298.15K	-185.588231
HF Energy	-185.588942
Nuclear repulsion energy	76.887408

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2490	2490	0.00
2	Σ_g	885	885	0.00
3	Σ_u	2308	2308	0.03
4	Π_g	576	576	0.00
4	Π_g	576	576	0.00
5	Π_u	261	261	22.32
5	Π_u	261	261	22.32

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.691
C2	0.000	0.000	-0.691
N3	0.000	0.000	1.844
N4	0.000	0.000	-1.844

	C1	C2	N3	N4
C1		1.3822	1.1533	2.5355
C2	1.3822		2.5355	1.1533
N3	1.1533	2.5355		3.6887
N4	2.5355	1.1533	3.6887

Number	Element	Mulliken
1	C	0.294
2	C	0.294
3	N	-0.294
4	N	-0.294

All results from a given calculation for C₂N₂ (Cyanogen)

using model chemistry: wB97X-D/6-31G(2df,p)

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>	67.988
(<r²>)^1/2	8.245

All results from a given calculation for C2N2 (Cyanogen)

using model chemistry: wB97X-D/6-31G(2df,p)

States and conformations

All results from a given calculation for C₂N₂ (Cyanogen)