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	hartrees
Energy at 0K	-186.506834
Energy at 298.15K
HF Energy	-185.814128
Nuclear repulsion energy	92.537226

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3241	3056	2.98
2	A'	3120	2943	10.78
3	A'	2351	2217	27.27
4	A'	1738	1639	21.18
5	A'	1522	1435	15.44
6	A'	1253	1182	9.72
7	A'	953	899	5.69
8	A'	641	605	3.96
9	A'	258	243	6.56
10	A"	1115	1051	19.25
11	A"	791	746	0.96
12	A"	378	356	9.97

Atom	x (Å)	y (Å)
C1	0.086	-1.537
N2	-0.635	-0.489
C3	0.000	0.709
N4	0.453	1.771
H5	-0.417	-2.496
H6	1.174	-1.517

	C1	N2	C3	N4	H5	H6
C1		1.2722	2.2477	3.3285	1.0834	1.0882
N2	1.2722		1.3560	2.5086	2.0192	2.0809
C3	2.2477	1.3560		1.1548	3.2324	2.5167
N4	3.3285	2.5086	1.1548		4.3554	3.3663
H5	1.0834	2.0192	3.2324	4.3554		1.8685
H6	1.0882	2.0809	2.5167	3.3663	1.8685

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	117.531	N2	C1	H5	117.785
N2	C1	H6	123.486	N2	C3	N4	175.176
H5	C1	H6	118.728

All results from a given calculation for H₂CNCN (cyanamide, methylene)

using model chemistry: CCD/6-311+G(3df,2p)

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 H2CNCN (cyanamide, methylene)

using model chemistry: CCD/6-311+G(3df,2p)

States and conformations

All results from a given calculation for H₂CNCN (cyanamide, methylene)