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	hartrees
Energy at 0K	-184.660675
Energy at 298.15K	-184.660072
HF Energy	-184.660675
Nuclear repulsion energy	77.963269

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2718	2463	0.00
2	Σ_g	916	830	0.00
3	Σ_u	2522	2286	3.29
4	Π_g	611	554	0.00
4	Π_g	611	554	0.00
5	Π_u	282	256	27.62
5	Π_u	282	256	27.62

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.686
C2	0.000	0.000	-0.686
N3	0.000	0.000	1.807
N4	0.000	0.000	-1.807

	C1	C2	N3	N4
C1		1.3729	1.1206	2.4935
C2	1.3729		2.4935	1.1206
N3	1.1206	2.4935		3.6141
N4	2.4935	1.1206	3.6141

Number	Element	Mulliken
1	C	0.052
2	C	0.052
3	N	-0.052
4	N	-0.052

All results from a given calculation for C₂N₂ (Cyanogen)

using model chemistry: HF/Def2TZVPP

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>	67.450
(<r²>)^1/2	8.213

All results from a given calculation for C2N2 (Cyanogen)

using model chemistry: HF/Def2TZVPP

States and conformations

All results from a given calculation for C₂N₂ (Cyanogen)