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	hartrees
Energy at 0K	-147.301221
Energy at 298.15K	-147.301071
HF Energy	-146.674561
Nuclear repulsion energy	52.730857

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1649	1649	14.37
2	A₁	1171	1171	24.30
3	B₂	1060	1060	0.06

Atom	y (Å)	z (Å)
C1	0.000	0.855
N2	0.635	-0.366
N3	-0.635	-0.366

	C1	N2	N3
C1		1.3762	1.3762
N2	1.3762		1.2692
N3	1.3762	1.2692

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	N3	62.539		C1	N3	N2	62.539
N2	C1	N3	54.921

All results from a given calculation for CN₂ (3H-Diazirin-3-ylidene)

using model chemistry: CCSD=FULL/aug-cc-pVQZ

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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All results from a given calculation for CN2 (3H-Diazirin-3-ylidene)

using model chemistry: CCSD=FULL/aug-cc-pVQZ

States and conformations

All results from a given calculation for CN₂ (3H-Diazirin-3-ylidene)