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	hartrees
Energy at 0K	-132.624688
Energy at 298.15K
HF Energy	-132.433838
Nuclear repulsion energy	61.220131

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3173	3173	3.06
2	A'	3138	3138	2.35
3	A'	2008	2008	279.64
4	A'	1506	1506	4.65
5	A'	1222	1222	7.52
6	A'	884	884	424.50
7	A'	695	695	89.22
8	A'	490	490	33.46
9	A"	3284	3284	0.74
10	A"	1150	1150	6.52
11	A"	965	965	10.29
12	A"	358	358	3.99

Atom	x (Å)	y (Å)	z (Å)
C1	0.124	-1.173	0.000
N2	0.000	0.101	0.000
C3	-0.269	1.284	0.000
H4	0.170	-1.697	0.940
H5	0.170	-1.697	-0.940
H6	0.530	2.021	0.000

	C1	N2	C3	H4	H5	H6
C1		1.2801	2.4876	1.0774	1.0774	3.2190
N2	1.2801		1.2125	2.0362	2.0362	1.9910
C3	2.4876	1.2125		3.1559	3.1559	1.0868
H4	1.0774	2.0362	3.1559		1.8804	3.8513
H5	1.0774	2.0362	3.1559	1.8804		3.8513
H6	3.2190	1.9910	1.0868	3.8513	3.8513

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	172.741	N2	C1	H4	119.229
N2	C1	H5	119.229	N2	C3	H6	119.879
H4	C1	H5	121.540

All results from a given calculation for H₂CNCH (methyleneaminomethylene)

using model chemistry: B2PLYP=FULLultrafine/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 H2CNCH (methyleneaminomethylene)

using model chemistry: B2PLYP=FULLultrafine/Def2TZVPP

States and conformations

All results from a given calculation for H₂CNCH (methyleneaminomethylene)