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	hartrees
Energy at 0K	-186.716220
Energy at 298.15K
HF Energy	-186.510795
Nuclear repulsion energy	91.711448

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3234	3234	3.52	82.98	0.59	0.75
2	A'	3101	3101	15.63	107.25	0.09	0.16
3	A'	2228	2228	22.79	218.67	0.22	0.36
4	A'	1676	1676	21.10	51.99	0.19	0.31
5	A'	1497	1497	15.57	26.63	0.35	0.52
6	A'	1223	1223	9.54	2.75	0.67	0.80
7	A'	944	944	5.58	2.11	0.06	0.12
8	A'	623	623	3.31	4.33	0.14	0.24
9	A'	250	250	5.94	8.14	0.45	0.62
10	A"	1103	1103	19.31	0.75	0.75	0.86
11	A"	772	772	0.84	1.82	0.75	0.86
12	A"	362	362	7.74	0.19	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.097	-1.560
N2	-0.619	-0.492
C3	0.000	0.708
N4	0.427	1.803
H5	-0.424	-2.518
H6	1.193	-1.553

	C1	N2	C3	N4	H5	H6
C1		1.2855	2.2701	3.3791	1.0905	1.0958
N2	1.2855		1.3511	2.5227	2.0348	2.0998
C3	2.2701	1.3511		1.1751	3.2538	2.5567
N4	3.3791	2.5227	1.1751		4.4039	3.4428
H5	1.0905	2.0348	3.2538	4.4039		1.8825
H6	1.0958	2.0998	2.5567	3.4428	1.8825

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	118.842	N2	C1	H5	117.600
N2	C1	H6	123.527	N2	C3	N4	173.993
H5	C1	H6	118.873

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

using model chemistry: B2PLYP=FULL/daug-cc-pVDZ

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: B2PLYP=FULL/daug-cc-pVDZ

States and conformations

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