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	hartrees
Energy at 0K	-184.569983
Energy at 298.15K	-184.569633
HF Energy	-184.569983
Nuclear repulsion energy	76.776253

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2473	2366	0.00
2	Σ_g	902	863	0.00
3	Σ_u	2269	2170	0.22
4	Π_g	790	756	0.00
4	Π_g	790	756	0.00
5	Π_u	323	309	10.69
5	Π_u	323	309	10.69

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.681
C2	0.000	0.000	-0.681
N3	0.000	0.000	1.846
N4	0.000	0.000	-1.846

	C1	C2	N3	N4
C1		1.3618	1.1646	2.5264
C2	1.3618		2.5264	1.1646
N3	1.1646	2.5264		3.6910
N4	2.5264	1.1646	3.6910

Number	Element	Mulliken
1	C	0.421
2	C	0.421
3	N	-0.421
4	N	-0.421

All results from a given calculation for C₂N₂ (Cyanogen)

using model chemistry: B1B95/3-21G

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>	67.994
(<r²>)^1/2	8.246

All results from a given calculation for C2N2 (Cyanogen)

using model chemistry: B1B95/3-21G

States and conformations

All results from a given calculation for C₂N₂ (Cyanogen)