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	hartrees
Energy at 0K	-132.617980
Energy at 298.15K	-132.620522
HF Energy	-132.617980
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3186	3186	1.05
2	A'	3127	3127	15.71
3	A'	2038	2038	224.45
4	A'	1533	1533	1.24
5	A'	1255	1255	11.26
6	A'	932	932	353.79
7	A'	762	762	78.78
8	A'	496	496	28.13
9	A"	3299	3299	3.81
10	A"	1167	1167	6.80
11	A"	987	987	8.96
12	A"	349	349	3.81

Atom	x (Å)	y (Å)	z (Å)
C1	0.111	-1.170	0.000
N2	0.000	0.098	0.000
C3	-0.263	1.293	0.000
H4	0.160	-1.700	0.944
H5	0.160	-1.700	-0.944
H6	0.594	1.976	0.000

	C1	N2	C3	H4	H5	H6
C1		1.2733	2.4917	1.0834	1.0834	3.1832
N2	1.2733		1.2237	2.0372	2.0372	1.9695
C3	2.4917	1.2237		3.1671	3.1671	1.0957
H4	1.0834	2.0372	3.1671		1.8873	3.8201
H5	1.0834	2.0372	3.1671	1.8873		3.8201
H6	3.1832	1.9695	1.0957	3.8201	3.8201

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	C3	172.574	N2	C1	H4	119.421
N2	C1	H5	119.421	N2	C3	H6	116.133
H4	C1	H5	121.156

All results from a given calculation for H₂CNCH (methyleneaminomethylene)

using model chemistry: wB97X-D/6-31G**

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	-0.199
2	N	-0.133
3	C	-0.120
4	H	0.153
5	H	0.153
6	H	0.145

	x	y	z	Total
	1.453	-1.063	0.000	1.800
CHELPG
AIM
ESP

	x	y	z
x	2.337	-0.668	0.000
y	-0.668	8.744	0.000
z	0.000	0.000	2.638

<r²>	41.715
(<r²>)^1/2	6.459

All results from a given calculation for H2CNCH (methyleneaminomethylene)

using model chemistry: wB97X-D/6-31G**

States and conformations

All results from a given calculation for H₂CNCH (methyleneaminomethylene)