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	hartrees
Energy at 0K	-186.460549
Energy at 298.15K
HF Energy	-185.765588
Nuclear repulsion energy	92.183373

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'	3281	3084	2.96	67.34	0.59	0.74
2	A'	3154	2964	8.97	78.00	0.12	0.22
3	A'	2216	2083	8.04	107.39	0.28	0.44
4	A'	1687	1586	15.52	19.77	0.21	0.35
5	A'	1519	1428	10.60	22.33	0.41	0.58
6	A'	1240	1166	8.50	3.14	0.75	0.85
7	A'	954	896	5.94	1.32	0.01	0.02
8	A'	632	594	4.54	1.37	0.25	0.39
9	A'	257	241	5.93	6.33	0.51	0.67
10	A"	1100	1034	18.16	0.10	0.75	0.86
11	A"	801	753	1.21	4.86	0.75	0.86
12	A"	412	387	9.54	0.46	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.080	-1.546
N2	-0.631	-0.483
C3	0.000	0.703
N4	0.458	1.783
H5	-0.436	-2.499
H6	1.168	-1.544

	C1	N2	C3	N4	H5	H6
C1		1.2795	2.2503	3.3506	1.0834	1.0881
N2	1.2795		1.3428	2.5138	2.0255	2.0890
C3	2.2503	1.3428		1.1734	3.2310	2.5322
N4	3.3506	2.5138	1.1734		4.3741	3.4019
H5	1.0834	2.0255	3.2310	4.3741		1.8670
H6	1.0881	2.0890	2.5322	3.4019	1.8670

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	118.199	N2	C1	H5	117.771
N2	C1	H6	123.649	N2	C3	N4	174.941
H5	C1	H6	118.580

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

using model chemistry: MP2=FULL/6-31G(2df,p)

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=FULL/6-31G(2df,p)

States and conformations

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