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	hartrees
Energy at 0K	-132.637858
Energy at 298.15K	-132.640313
HF Energy	-132.637858
Nuclear repulsion energy	60.663228

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3074	3058	0.73
2	A'	3000	2983	18.50
3	A'	1973	1962	136.22
4	A'	1460	1452	2.10
5	A'	1193	1187	6.91
6	A'	928	923	281.69
7	A'	648	645	65.66
8	A'	477	474	15.61
9	A"	3174	3157	3.06
10	A"	1116	1110	5.50
11	A"	939	934	7.62
12	A"	346	344	2.41

Atom	x (Å)	y (Å)	z (Å)
C1	0.211	-1.167	0.000
N2	0.000	0.102	0.000
C3	-0.377	1.271	0.000
H4	0.301	-1.698	0.947
H5	0.301	-1.698	-0.947
H6	0.393	2.061	0.000

	C1	N2	C3	H4	H5	H6
C1		1.2860	2.5075	1.0896	1.0896	3.2331
N2	1.2860		1.2283	2.0561	2.0561	1.9984
C3	2.5075	1.2283		3.1894	3.1894	1.1029
H4	1.0896	2.0561	3.1894		1.8939	3.8779
H5	1.0896	2.0561	3.1894	1.8939		3.8779
H6	3.2331	1.9984	1.1029	3.8779	3.8779

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	171.576	N2	C1	H4	119.653
N2	C1	H5	119.653	N2	C3	H6	117.913
H4	C1	H5	120.694

All results from a given calculation for H₂CNCH (methyleneaminomethylene)

using model chemistry: BLYP/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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Number	Element	Mulliken
1	C	-0.271
2	N	0.173
3	C	-0.276
4	H	0.120
5	H	0.120
6	H	0.134

	x	y	z	Total
	1.287	-0.819	0.000	1.525
CHELPG
AIM
ESP

	x	y	z
x	2.817	-1.104	0.000
y	-1.104	8.619	0.000
z	0.000	0.000	2.945

<r²>	42.320
(<r²>)^1/2	6.505

All results from a given calculation for H2CNCH (methyleneaminomethylene)

using model chemistry: BLYP/6-31G(2df,p)

States and conformations

All results from a given calculation for H₂CNCH (methyleneaminomethylene)