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	hartrees
Energy at 0K	-185.500341
Energy at 298.15K	-185.499524
HF Energy	-185.301354
Nuclear repulsion energy	76.064131

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ_g	2352	2240	0.00
2	Σ_g	879	837	0.00
3	Σ_u	2179	2076	1.43
4	Π_g	535	510	0.00
4	Π_g	535	510	0.00
5	Π_u	243	232	18.09
5	Π_u	243	232	18.09

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	1.863
N4	0.000	0.000	-1.863

	C1	C2	N3	N4
C1		1.3821	1.1722	2.5543
C2	1.3821		2.5543	1.1722
N3	1.1722	2.5543		3.7265
N4	2.5543	1.1722	3.7265

Number	Element	Mulliken
1	C	0.481
2	C	0.481
3	N	-0.481
4	N	-0.481

All results from a given calculation for C₂N₂ (Cyanogen)

using model chemistry: B2PLYP/6-31+G**

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>	69.600
(<r²>)^1/2	8.343

All results from a given calculation for C2N2 (Cyanogen)

using model chemistry: B2PLYP/6-31+G**

States and conformations

All results from a given calculation for C₂N₂ (Cyanogen)