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	hartrees
Energy at 0K	-186.676635
Energy at 298.15K
HF Energy	-185.825755
Nuclear repulsion energy	92.435638

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'	3266	3126	2.12	73.36	0.58	0.73
2	A'	3135	3001	12.37	97.06	0.10	0.18
3	A'	2197	2103	11.58	145.45	0.25	0.39
4	A'	1687	1615	13.19	29.81	0.18	0.30
5	A'	1515	1450	14.50	22.42	0.38	0.55
6	A'	1242	1189	9.68	2.24	0.75	0.86
7	A'	954	913	6.72	1.55	0.03	0.06
8	A'	621	594	3.43	2.11	0.15	0.27
9	A'	248	237	6.10	6.73	0.50	0.66
10	A"	1105	1058	19.10	0.25	0.75	0.86
11	A"	783	750	0.66	2.22	0.75	0.86
12	A"	364	348	8.59	0.16	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.086	-1.542
N2	-0.629	-0.486
C3	0.000	0.701
N4	0.448	1.780
H5	-0.425	-2.492
H6	1.170	-1.526

	C1	N2	C3	N4	H5	H6
C1		1.2755	2.2443	3.3419	1.0787	1.0840
N2	1.2755		1.3426	2.5087	2.0164	2.0780
C3	2.2443	1.3426		1.1689	3.2206	2.5154
N4	3.3419	2.5087	1.1689		4.3604	3.3842
H5	1.0787	2.0164	3.2206	4.3604		1.8648
H6	1.0840	2.0780	2.5154	3.3842	1.8648

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	117.993	N2	C1	H5	117.614
N2	C1	H6	123.245	N2	C3	N4	174.628
H5	C1	H6	119.141

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

using model chemistry: MP2=FULL/cc-pVQZ

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/cc-pVQZ

States and conformations

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