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	hartrees
Energy at 0K	-186.510508
Energy at 298.15K
HF Energy	-185.818479
Nuclear repulsion energy	92.025469

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'	3256	3098	2.78	74.40	0.58	0.73
2	A'	3126	2975	12.38	97.51	0.11	0.20
3	A'	2177	2071	9.14	138.81	0.25	0.40
4	A'	1672	1591	11.38	26.02	0.17	0.29
5	A'	1511	1438	13.67	25.22	0.36	0.53
6	A'	1237	1177	9.00	2.62	0.75	0.86
7	A'	944	899	6.41	1.55	0.03	0.05
8	A'	621	590	2.80	1.85	0.18	0.30
9	A'	249	237	5.86	7.12	0.53	0.69
10	A"	1096	1043	19.47	0.22	0.75	0.86
11	A"	780	743	0.57	2.76	0.75	0.86
12	A"	364	347	8.24	0.18	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.088	-1.546
N2	-0.636	-0.488
C3	0.000	0.703
N4	0.453	1.786
H5	-0.422	-2.501
H6	1.175	-1.527

	C1	N2	C3	N4	H5	H6
C1		1.2815	2.2505	3.3524	1.0820	1.0872
N2	1.2815		1.3503	2.5221	2.0236	2.0872
C3	2.2505	1.3503		1.1746	3.2310	2.5199
N4	3.3524	2.5221	1.1746		4.3754	3.3906
H5	1.0820	2.0236	3.2310	4.3754		1.8701
H6	1.0872	2.0872	2.5199	3.3906	1.8701

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	117.519	N2	C1	H5	117.536
N2	C1	H6	123.357	N2	C3	N4	174.595
H5	C1	H6	119.107

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

using model chemistry: MP2/Def2TZVPP

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: MP2/Def2TZVPP

States and conformations

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