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	hartrees
Energy at 0K	-186.505406
Energy at 298.15K
HF Energy	-185.810415
Nuclear repulsion energy	92.051467

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'	3253	3069	2.00	73.45	0.59	0.74
2	A'	3122	2945	12.49	94.83	0.09	0.17
3	A'	2177	2053	12.38	163.74	0.23	0.37
4	A'	1672	1577	12.14	34.32	0.15	0.26
5	A'	1506	1421	14.31	23.02	0.35	0.52
6	A'	1235	1165	9.39	2.20	0.73	0.84
7	A'	946	892	6.75	2.06	0.04	0.09
8	A'	616	581	2.92	2.48	0.12	0.22
9	A'	247	233	6.21	6.79	0.48	0.65
10	A"	1092	1030	20.07	0.53	0.75	0.86
11	A"	779	735	0.60	1.69	0.75	0.86
12	A"	360	339	8.37	0.13	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.089	-1.548
N2	-0.631	-0.489
C3	0.000	0.703
N4	0.447	1.789
H5	-0.422	-2.502
H6	1.177	-1.531

	C1	N2	C3	N4	H5	H6
C1		1.2810	2.2524	3.3554	1.0827	1.0880
N2	1.2810		1.3484	2.5195	2.0239	2.0872
C3	2.2524	1.3484		1.1741	3.2324	2.5247
N4	3.3554	2.5195	1.1741		4.3776	3.3987
H5	1.0827	2.0239	3.2324	4.3776		1.8715
H6	1.0880	2.0872	2.5247	3.3987	1.8715

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	117.856	N2	C1	H5	117.550
N2	C1	H6	123.330	N2	C3	N4	174.449
H5	C1	H6	119.120

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

using model chemistry: MP2/6-311+G(3df,2p)

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: MP2/6-311+G(3df,2p)

States and conformations

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