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	hartrees
Energy at 0K	-131.869238
Energy at 298.15K	-131.871889
HF Energy	-131.869238
Nuclear repulsion energy	61.838698

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3265	2972	0.21
2	A'	3178	2892	24.60
3	A'	2032	1849	196.82
4	A'	1650	1502	0.28
5	A'	1291	1175	16.53
6	A'	1089	991	322.73
7	A'	1003	913	57.05
8	A'	518	471	31.38
9	A"	3367	3064	8.05
10	A"	1266	1152	13.63
11	A"	1071	974	10.90
12	A"	312	284	4.65

Atom	x (Å)	y (Å)	z (Å)
C1	-0.077	-1.151	0.000
N2	0.000	0.091	0.000
C3	-0.044	1.313	0.000
H4	-0.109	-1.687	0.930
H5	-0.109	-1.687	-0.930
H6	0.944	1.767	0.000

	C1	N2	C3	H4	H5	H6
C1		1.2443	2.4638	1.0738	1.0738	3.0916
N2	1.2443		1.2224	2.0093	2.0093	1.9237
C3	2.4638	1.2224		3.1410	3.1410	1.0873
H4	1.0738	2.0093	3.1410		1.8598	3.7289
H5	1.0738	2.0093	3.1410	1.8598		3.7289
H6	3.0916	1.9237	1.0873	3.7289	3.7289

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	174.395	N2	C1	H4	119.998
N2	C1	H5	119.998	N2	C3	H6	112.661
H4	C1	H5	120.003

All results from a given calculation for H₂CNCH (methyleneaminomethylene)

using model chemistry: HF/cc-pVTZ

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	-0.163
2	N	0.034
3	C	-0.259
4	H	0.124
5	H	0.124
6	H	0.140

	x	y	z	Total
	1.415	-2.004	0.000	2.453
CHELPG
AIM
ESP

	x	y	z
x	3.126	0.301	0.000
y	0.301	9.207	0.000
z	0.000	0.000	3.150

<r²>	41.348
(<r²>)^1/2	6.430

All results from a given calculation for H2CNCH (methyleneaminomethylene)

using model chemistry: HF/cc-pVTZ

States and conformations

All results from a given calculation for H₂CNCH (methyleneaminomethylene)