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	hartrees
Energy at 0K	-186.519310
Energy at 298.15K
HF Energy	-185.817558
Nuclear repulsion energy	92.501332

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3235	3096	3.02
2	A'	3116	2982	10.50
3	A'	2348	2247	26.88
4	A'	1735	1661	21.11
5	A'	1519	1453	15.40
6	A'	1251	1197	9.71
7	A'	951	910	5.53
8	A'	641	614	3.88
9	A'	258	247	6.51
10	A"	1116	1068	19.12
11	A"	790	756	0.86
12	A"	377	361	9.80

Atom	x (Å)	y (Å)
C1	0.085	-1.536
N2	-0.638	-0.489
C3	0.000	0.709
N4	0.457	1.771
H5	-0.418	-2.496
H6	1.173	-1.515

	C1	N2	C3	N4	H5	H6
C1		1.2730	2.2472	3.3279	1.0830	1.0880
N2	1.2730		1.3569	2.5104	2.0191	2.0813
C3	2.2472	1.3569		1.1557	3.2319	2.5146
N4	3.3279	2.5104	1.1557		4.3550	3.3630
H5	1.0830	2.0191	3.2319	4.3550		1.8685
H6	1.0880	2.0813	2.5146	3.3630	1.8685

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	117.375	N2	C1	H5	117.740
N2	C1	H6	123.478	N2	C3	N4	175.258
H5	C1	H6	118.782

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

using model chemistry: CCD/aug-cc-pVTZ

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/aug-cc-pVTZ

States and conformations

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